Defactinib
N-methyl-4-[[4-[[3-[methyl(methylsulfonyl)amino]pyrazin-2-yl]methylamino]-5-(trifluoromethyl)pyrimidin-2-yl]amino]benzamide
Molecular Identity
Defactinib
N-methyl-4-[[4-[[3-[methyl(methylsulfonyl)amino]pyrazin-2-yl]methylamino]-5-(trifluoromethyl)pyrimidin-2-yl]amino]benzamide
PubChem CID: 25117126
2D Structure
Properties
C20H21F3N8O3S
Molecular Formula
510.50
Molecular Weight
g/mol
510.1409
Exact Mass
Da
1.4
XLogP
Drug-like (Lipinski: < 5)
150
TPSA
May have limited oral absorption
3
H-Bond Donors
13
H-Bond Acceptors
804
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Defactinib1073154-85-4VS-6063N-methyl-4-((4-(((3-(N-methylmethylsulfonamido)pyrazin-2-yl)methyl)amino)-5-(trifluoromethyl)pyrimidin-2-yl)amino)benzamide53O87HA2QUBenzamide, N-methyl-4-((4-(((3-(methyl(methylsulfonyl)amino)-2-pyrazinyl)methyl)amino)-5-(trifluoromethyl)-2-pyrimidinyl)amino)-N-methyl-4-((4-(((3-methyl(methylsulfonyl)aminopyrazin-2-yl)methyl)amino)-5-(trifluoromethyl)pyrimidin-2-yl)amino)benzamidedefactinibumRefChem:919757N-methyl-4-((4-(((3-(N-methylmethanesulfonamido)pyrazin-2-yl)methyl)amino)-5-(trifluoromethyl)pyrimidin-2-yl)amino)benzamidePF-045548781345713-71-4N-methyl-4-[[4-[[3-[methyl(methylsulfonyl)amino]pyrazin-2-yl]methylamino]-5-(trifluoromethyl)pyrimidin-2-yl]amino]benzamideDefactinib (VS-6063, PF-04554878)MFCD25977806
Data from PubChem (NCBI)
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Drug Network
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