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Chemical structure of DCH36_06

GC63627

DCH36_06

Also known as (5E)-1-(3-chloro-4-methylphenyl)-5-[(E)-3-(furan-2-yl)prop-2-enylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

DCH36_06 is a potent and selective p300/CBP inhibitor with IC50s of 0·6 μM and 3·2 μM for p300 and CBP, respectively· DCH36_06 mediated p300/CBP inhibition leading to hypoacetylation on H3K18 in leukemic cells· Anti-tumor activity

ChemicalCAS593273-05-3MW372.83FormulaC18H13ClN2O3S
CAS number
593273-05-3
Molecular weight
372.83
Formula
C18H13ClN2O3S
Solubility
DMSO ： 125 mg/mL (335·27 mM; Need ultrasonic)
InChIKey
AYNCXNUUERDREH-FMDPHQNASA-N
Catalogue number
GC63627
Brand
GLPBIO
Computed properties PubChem CID 1797299 · XLogP 4 · TPSA 94.6 Ų · H-bond donors 1
XLogP
4
TPSA
94.6 Ų
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
25

SMILES CC1=C(C=C(C=C1)N2C(=O)/C(=C/C=C/C3=CC=CO3)/C(=O)NC2=S)Cl

Computed descriptors from PubChem (CID 1797299), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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