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Chemical structure of BMS-191095

GC31405

BMS-191095

Also known as (3R,4S)-4-[4-chloro-N-(1H-imidazol-2-ylmethyl)anilino]-3-hydroxy-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile

BMS-191095 is an activators of mitochondrial ATP-sensitive potassium (mitoKATP) channels

ChemicalCAS166095-21-2MW408.88FormulaC22H21ClN4O2
CAS number
166095-21-2
Molecular weight
408.88
Formula
C22H21ClN4O2
Solubility
DMSO ： ≥ 50 mg/mL (122·29 mM)
InChIKey
SMIKIPXIDLITMP-LEWJYISDSA-N
Catalogue number
GC31405
Brand
GLPBIO
Computed properties PubChem CID 9822753 · XLogP 3.3 · TPSA 85.2 Ų · H-bond donors 2
XLogP
3.3
TPSA
85.2 Ų
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
29

SMILES CC1([C@@H]([C@H](C2=C(O1)C=CC(=C2)C#N)N(CC3=NC=CN3)C4=CC=C(C=C4)Cl)O)C

Computed descriptors from PubChem (CID 9822753), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
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