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Chemical structure of Complement factor D-IN-2

GC62901

Complement factor D-IN-2

Also known as (1R,3S,5R)-2-[2-[3-acetyl-5-(2-methylpyrimidin-5-yl)indazol-1-yl]acetyl]-N-(6-bromo-2-pyridinyl)-2-azabicyclo[3.1.0]hexane-3-carboxamide

Complement factor D-IN-2 is an inhibitor of complement factor D extracted from patent WO2015130838A1, compound 190

ChemicalCAS1903742-34-6MW574.43FormulaC27H24BrN7O3
CAS number
1903742-34-6
Molecular weight
574.43
Formula
C27H24BrN7O3
InChIKey
JLRVDNFYMDBUJT-YHYVQYDKSA-N
Catalogue number
GC62901
Brand
GLPBIO
Computed properties PubChem CID 118323545 · XLogP 3.3 · TPSA 123 Ų · H-bond donors 1
XLogP
3.3
TPSA
123 Ų
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
38

SMILES CC1=NC=C(C=N1)C2=CC3=C(C=C2)N(N=C3C(=O)C)CC(=O)N4[C@@H]5C[C@@H]5C[C@H]4C(=O)NC6=NC(=CC=C6)Br

Computed descriptors from PubChem (CID 118323545), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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