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Chemical structure of BM-1244

GC62871

BM-1244

Also known as 1-[(3R)-3-[4-[[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]sulfamoyl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidine-4-carboxylic acid

BM-1244 (APG-1252-M1) is a potent Bcl-xL/Bcl-2 inhibitor with Kis of 134 and 450 nM for Bcl- xL and Bcl-2, respectively· BM-1244 inhibits senescent fibroblasts (SnCs) with an EC50 of 5 nM· (From patent WO2019033119A1)

ChemicalCAS1619923-32-8MW1159.79FormulaC54H59ClF4N6O8S4
CAS number
1619923-32-8
Molecular weight
1159.79
Formula
C54H59ClF4N6O8S4
Solubility
DMSO ： 200 mg/mL (172·45 mM; Need ultrasonic)
InChIKey
OGHPBBHWAPIYHS-VZUYHUTRSA-N
Catalogue number
GC62871
Brand
GLPBIO
Computed properties PubChem CID 90279478 · XLogP 8.6 · TPSA 229 Ų · H-bond donors 3
XLogP
8.6
TPSA
229 Ų
H-bond donors
3
H-bond acceptors
18
Rotatable bonds
19
Heavy atoms
77

SMILES CC1=C(C(=C(N1C(C)C)C2=CC=C(C=C2)Cl)C3=CC(=CC(=C3)F)N4CCN(CC4)C5=CC=C(C=C5)NS(=O)(=O)C6=CC(=C(C=C6)N[C@H](CCN7CCC(CC7)C(=O)O)CSC8=CC=CC=C8)S(=O)(=O)C(F)(F)F)S(=O)(=O)C

Computed descriptors from PubChem (CID 90279478), 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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