Plx4032
N-[2,4-difluoro-3-(5-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridine-3-carbonyl)phenyl]propane-2-sulfonamide
Molecular Identity
Plx4032
N-[2,4-difluoro-3-(5-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridine-3-carbonyl)phenyl]propane-2-sulfonamide
PubChem CID: 53438230
2D Structure
Properties
C22H18F2N4O3S
Molecular Formula
456.50
Molecular Weight
g/mol
456.1068
Exact Mass
Da
3.2
XLogP
Drug-like (Lipinski: < 5)
113
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
8
H-Bond Acceptors
778
Complexity
SMILES
Canonical SMILES
SMILES: CC(C)S(=O)(=O)NC1=C(C(=C(C=C1)F)C(=O)C2=CNC3=C2C=C(C=N3)C4=CN=CC=C4)FIsomeric SMILES
SMILES: CC(C)S(=O)(=O)NC1=C(C(=C(C=C1)F)C(=O)C2=CNC3=C2C=C(C=N3)C4=CN=CC=C4)FSynonyms(20)
918505-61-0RefChem:929462Plx4032BRAF inhibitorN-[2,4-Difluoro-3-[[5-(3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl]phenyl]-2-propanesulfonamideN-(2,4-difluoro-3-(5-(pyridin-3-yl)-1H-pyrrolo[2,3-b]pyridine-3-carbonyl)phenyl)propane-2-sulfonamideSCHEMBL150401orb1309908C22H18F2N4O3SSCHEMBL30499049SUNCACOTKLUNHD-UHFFFAOYSA-NEX-A2629MFCD16659048AKOS025117572CS-0055
Data from PubChem (NCBI)
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