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Chemical structure of BM 567

GC14758

BM 567

Also known as 1-[2-(cyclohexylamino)-5-nitrophenyl]sulfonyl-3-pentylurea

dual acting antithrombogenic agent, acting as an inhibitor of thromboxane A2 (TXA2) synthase and as an antagonist of the TP receptor

ChemicalCAS284464-77-3MW412.5FormulaC18H28N4O5S
CAS number
284464-77-3
Molecular weight
412.5
Formula
C18H28N4O5S
Solubility
≤10mg/ml in ethanol;20mg/ml in DMSO;20mg/ml in dimethyl formamide
InChIKey
WNIPBGJWMANRGA-UHFFFAOYSA-N
Catalogue number
GC14758
Brand
GLPBIO
Computed properties PubChem CID 9866368 · XLogP 4.5 · TPSA 142 Ų · H-bond donors 3
XLogP
4.5
TPSA
142 Ų
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
28

SMILES CCCCCNC(=O)NS(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NC2CCCCC2

Computed descriptors from PubChem (CID 9866368), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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