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Tucidinostat (Chidamide)

CAT: 0957-S8567-100mgSize: 100 mgDry Ice: YesHazardous: No
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CAT#:0957-S8567-100mgSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1616493-44-7
Synonyms
HBI-8000, CS-055
Target
HDAC
Applications
DNA Damage/DNA Repair
Smiles
C1=CC (=CN=C1) C=CC (=O) NCC2=CC=C (C=C2) C (=O) NC3=C (C=C (C=C3) F) N
Molecular Formula
C22H19FN4O2
Additionnal Information
Tucidinostat (Chidamide, HBI-8000, CS-055) is a low nanomolar inhibitor of HDAC1, 2, 3, and 10, the HDAC isotypes well documented to be associated with the malignant phenotype with IC50 values of 95, 160, 67, 78 nM for HDAC1, 2, 3, 10 respectively.
Storage Conditions
2 years -80 in solvent

Chemical Information

Tucidinostat

Chidamide is a member of benzamides.

CAS Number1616493-44-7
PubChem CID12136798
IUPAC NameN-(2-amino-4-fluorophenyl)-4-[[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]methyl]benzamide
Molecular FormulaC22H19FN4O2
Molecular Weight390.4
XLogP2.3
Topological Polar Surface Area97.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count29
Formal Charge0
Complexity577
SMILES
C1=CC(=CN=C1)/C=C/C(=O)NCC2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)F)N
InChI
InChI=1S/C22H19FN4O2/c23-18-8-9-20(19(24)12-18)27-22(29)17-6-3-16(4-7-17)14-26-21(28)10-5-15-2-1-11-25-13-15/h1-13H,14,24H2,(H,26,28)(H,27,29)/b10-5+
InChIKey
SZMJVTADHFNAIS-BJMVGYQFSA-N
Chemical Structure
2D Structure
2D structure of Tucidinostat
CAS: 1616493-44-7
CID: 12136798
Formula: C22H19FN4O2
MW: 390.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight390.4
XLogP32.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass390.14920402
Monoisotopic Mass390.14920402
Topological Polar Surface Area97.1 Ų
Heavy Atom Count29
Formal Charge0
Complexity577
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
C13502-10mM/1mLTucidinostat (Chidamide)
AR-C07090-01Chidamide (Tucidinostat)
A17861-500Tucidinostat (Chidamide) 500mg
A17861-10Tucidinostat (Chidamide) 10mg
A17861-200Tucidinostat (Chidamide) 200mg
A17861-50Tucidinostat (Chidamide) 50mg
A17861-25Tucidinostat (Chidamide) 25mg
A17861-100Tucidinostat (Chidamide) 100mg
A17861-5Tucidinostat (Chidamide) 5mg
AR-C07091-01Chidamide-d4 (Tucidinostat-d4)

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