5-[[4-(Pyridin-3-ylmethylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]indol-2-one
5-[[4-(pyridin-3-ylmethylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]indol-2-one
Molecular Identity
5-[[4-(Pyridin-3-ylmethylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]indol-2-one
5-[[4-(pyridin-3-ylmethylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]indol-2-one
PubChem CID: 155490992
2D Structure
Properties
C19H13F3N6O
Molecular Formula
398.30
Molecular Weight
g/mol
398.1103
Exact Mass
Da
2.4
XLogP
Drug-like (Lipinski: < 5)
92.2
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
9
H-Bond Acceptors
772
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC(=CN=C1)CNC2=NC(=NC=C2C(F)(F)F)NC3=CC4=CC(=O)N=C4C=C3Isomeric SMILES
SMILES: C1=CC(=CN=C1)CNC2=NC(=NC=C2C(F)(F)F)NC3=CC4=CC(=O)N=C4C=C3Synonyms(1)
PVT
Data from PubChem (NCBI)
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Molecular Structure
5-[[4-(Pyridin-3-ylmethylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]indol-2-one
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Drug Network
Trials and conditions connected to 5-[[4-(Pyridin-3-ylmethylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]indol-2-one
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