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Chemical structure of Factor B-IN-1

GC64892

Factor B-IN-1

Also known as 2-[hydroxy-(5-methoxy-7-methyl-1H-indol-4-yl)methyl]-3H-benzimidazole-5-carbonitrile

Factor B-IN-1 is a Factor B inhibitor extracted from patent WO2013164802A1, Example 24

ChemicalCAS1481631-75-7MW332.36FormulaC19H16N4O2
CAS number
1481631-75-7
Molecular weight
332.36
Formula
C19H16N4O2
InChIKey
IAUVRHDNBNIFFB-UHFFFAOYSA-N
Catalogue number
GC64892
Brand
GLPBIO
Computed properties PubChem CID 72188758 · XLogP 2.5 · TPSA 97.7 Ų · H-bond donors 3
XLogP
2.5
TPSA
97.7 Ų
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
25

SMILES CC1=CC(=C(C2=C1NC=C2)C(C3=NC4=C(N3)C=C(C=C4)C#N)O)OC

Computed descriptors from PubChem (CID 72188758), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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