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Chemical structure of BMS-819881

GC31479

BMS-819881

Also known as 6-(4-chlorophenyl)-3-[4-[(2R)-2-cyclopropyl-2-hydroxyethoxy]-3-methoxyphenyl]thieno[3,2-d]pyrimidin-4-one

BMS-819881 is a melaninconcentrating hormone receptor 1 (MCHR1) antagonist, which binds rat MCHR1 with a Ki of 7 nM

ChemicalCAS1197420-05-5MW468.95FormulaC24H21ClN2O4S
CAS number
1197420-05-5
Molecular weight
468.95
Formula
C24H21ClN2O4S
Solubility
Soluble in DMSO
InChIKey
WKMOSCAIWUUQPD-IBGZPJMESA-N
Catalogue number
GC31479
Brand
GLPBIO
Computed properties PubChem CID 44476451 · XLogP 4.8 · TPSA 99.6 Ų · H-bond donors 1
XLogP
4.8
TPSA
99.6 Ų
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
32

SMILES COC1=C(C=CC(=C1)N2C=NC3=C(C2=O)SC(=C3)C4=CC=C(C=C4)Cl)OC[C@@H](C5CC5)O

Computed descriptors from PubChem (CID 44476451), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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