Givinostat (CED0007692)

Record Information

Version

1.0

Creation Date

2026-04-05 11:41:12 UTC

Update Date

2026-08-22 03:31:50 UTC

Accession Number

CHEM100459

Identification

Common Name

Givinostat

Class

Small Molecule

Description

Givinostat is an organic compound with the chemical formula C24H27N3O4 and an average molecular weight of 421.50 g/mol. Givinostat belongs to the phenylcarbamic acid esters, a subclass of benzene and substituted derivatives within the organic compounds. This compound is recorded as being found in or released from one source: healthcare, pharmaceuticals & veterinary products, specifically drugs used for disorders of the musculo-skeletal system. The recorded route of exposure for this substance is oral. In terms of its biological activity, Givinostat acts on ten recorded protein targets. It serves as an inhibitor of histone deacetylase 1 (HDAC1), histone deacetylase 3 (HDAC3), histone deacetylase 4 (HDAC4), and histone deacetylase 7 (HDAC7), in addition to six other proteins.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₂₄H₂₇N₃O₄

Average Molecular Mass

421.497 g/mol

Monoisotopic Mass

421.200 g/mol

CAS Registry Number

497833-27-9

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

CCN(CC)CC1=CC2=C(C=C1)C=C(COC(=O)NC1=CC=C(C=C1)C(=O)NO)C=C2

InChI Identifier

InChI=1S/C24H27N3O4/c1-3-27(4-2)15-17-5-7-21-14-18(6-8-20(21)13-17)16-31-24(29)25-22-11-9-19(10-12-22)23(28)26-30/h5-14,30H,3-4,15-16H2,1-2H3,(H,25,29)(H,26,28)

InChI Key

YALNUENQHAQXEA-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as phenylcarbamic acid esters. These are ester derivatives of phenylcarbamic acids.

Kingdom

Organic compounds

Super Class

Benzenoids

Class

Benzene and substituted derivatives

Sub Class

Phenylcarbamic acid esters

Direct Parent

Phenylcarbamic acid esters

Alternative Parents

Substituents

Phenylcarbamic acid ester
Naphthalene
Benzoic acid or derivatives
Benzoyl
Aralkylamine
Carbamic acid ester
Amino acid or derivatives
Hydroxamic acid
Tertiary aliphatic amine
Tertiary amine
Carbonic acid derivative
Carboxylic acid derivative
Amine
Organonitrogen compound
Organooxygen compound
Hydrocarbon derivative
Organic oxide
Carbonyl group
Organopnictogen compound
Organic oxygen compound
Organic nitrogen compound
Aromatic homopolycyclic compound

Molecular Framework

Aromatic homopolycyclic compounds

External Descriptors

Not Available

Biological Properties

Status

Detected and Not Quantified

Origin

Not Available

Cellular Locations

Not Available

Biofluid Locations

Not Available

Tissue Locations

Not Available

Applications

Not Available

Biological Roles

Not Available

Chemical Roles

Not Available

Organoleptic Effects

Not Available

Physical Properties

State

Not Available

Appearance

Not Available

Experimental Properties

Property	Value
Melting Point	Not Available
Boiling Point	Not Available
Solubility	Not Available

Predicted Properties

Not Available

Spectra

Spectrum Type	Description	Splash Key	Deposition Date	View
Predicted GC-MS	Predicted GC-MS Spectrum	splash10-0umi-1923000000-e9447c197f88d5e1d9c5	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-00g1-0749600000-e533c0b01370a90a31e1	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-004i-0965000000-e32bb5b8fbb8e2dd9646	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-009l-2920000000-ca256a689f968fff7a21	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-004i-1910200000-3e40a526b825a3038aff	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-004l-5920000000-9e534acc1621f167c271	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0abc-9300000000-6a4e64a282ddb6f5362d	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-00b9-0190500000-158a25c21cefd1cf1d64	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-00ds-2429500000-2e009029c1c5d3fff1cf	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0a4i-1900000000-4c6a68bb0a8641360c79	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-00di-0600900000-24cc12213f968d5a2670	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0006-9650100000-3e07ce0816f1ef2036c0	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0006-9822000000-c627408576a61d6f215b	Not Available	View Spectrum

Toxicity Profile

Mechanism of Toxicity

Not Available

Carcinogenicity (IARC Classification)

Not Available

Minimum Risk Level

Not Available

Symptoms

Not Available

Treatment

Not Available

Toxicity Values

Toxicity Value	Unit	Value Range	Organism	Dose Descriptor	Route of Exposure	Predicted or Experimental	Reference
3409.0	Log mg/kg	[1900:6100]	Rat	LD50	oral	predicted	Not Available

Health Effects

Health Effect	Relationship	Direction	Reference

Exposure Sources

Source ID	Source	Sector	Reference
368	Drugs for disorders of the musculo-skeletal system	Healthcare, pharmaceuticals & veterinary products	Not Available
519	Electrodes	Electrical & Electronic Equipment	Not Available
696	Nanotechnology	Industrial manufacturing & chemical processing	Not Available

Pathways

0 pathways

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets

Structure	Protein	UniProt ID	Organism	Relationship	Details
Click to view 3D structure	Protein deacetylase HDAC6	Q9UBN7	Humans	Predicted (SEA)	16.6597
Click to view 3D structure	Histone deacetylase 1	Q13547	Humans	Predicted (SEA)	23.744
Click to view 3D structure	Histone deacetylase 8	Q9BY41	Humans	Predicted (SEA)	10.0426
Click to view 3D structure	Histone deacetylase 7	Q8WUI4	Humans	Predicted (SEA)	2.80257
Click to view 3D structure	Histone deacetylase 5	Q9UQL6	Humans	Predicted (SEA)	5.0602
Click to view 3D structure	Histone deacetylase 3	O15379	Humans	Predicted (SEA)	10.5875
Click to view 3D structure	Histone deacetylase 11	Q96DB2	Humans	Predicted (SEA)	4.12601
Click to view 3D structure	Histone deacetylase 2	Q92769	Humans	Predicted (SEA)	15.1027
Click to view 3D structure	Histone deacetylase 9	Q9UKV0	Humans	Predicted (SEA)	3.03612
Click to view 3D structure	Histone deacetylase 4	P56524	Humans	Predicted (SEA)	6.46149
Click to view 3D structure	Polyamine deacetylase HDAC10	Q969S8	Humans	Predicted (SEA)	3.81461
Click to view 3D structure	Leukotriene A-4 hydrolase	P09960	Humans	Predicted (SEA)	5.99439
Click to view 3D structure	Histone deacetylase HD1B	Q9ZTP8	Zea mays	Predicted (SEA)	0.233548
Click to view 3D structure	Urokinase-type plasminogen activator	P00749	Humans	Predicted (SEA)	61.3452
Click to view 3D structure	Histone deacetylase 8	A5H660	Schistosoma mansoni	Predicted (SEA)	19.5402
Click to view 3D structure	Serine protease 1	P07477	Humans	Predicted (SEA)	96.2216
Click to view 3D structure	Sentrin-specific protease 7	Q9BQF6	Humans	Predicted (SEA)	63.9142
Click to view 3D structure	Plasminogen	P00747	Humans	Predicted (SEA)	226.775
Click to view 3D structure	Acetylcholinesterase	P22303	Humans	Predicted (SEA)	302.678
Click to view 3D structure	Thyrotropin subunit beta	P01223	Bos taurus	Predicted (SEA)	2.56902
Click to view 3D structure	Amyloid-beta precursor protein	P05067	Humans	Predicted (SEA)	96.8444
Click to view 3D structure	Heat shock protein HSP 90-alpha	P07900	Humans	Predicted (SEA)	68.5852
Click to view 3D structure	Prothrombin	P00734	Humans	Predicted (SEA)	389.557
Click to view 3D structure	Plasma kallikrein	P03952	Humans	Predicted (SEA)	259.627
Click to view 3D structure	Kallikrein-1	P06870	Humans	Predicted (SEA)	122.145