DBPR112
(E)-4-(dimethylamino)-N-[3-[4-[[(1S)-2-hydroxy-1-phenylethyl]amino]-6-phenylfuro[2,3-d]pyrimidin-5-yl]phenyl]but-2-enamide
Molecular Identity
DBPR112
(E)-4-(dimethylamino)-N-[3-[4-[[(1S)-2-hydroxy-1-phenylethyl]amino]-6-phenylfuro[2,3-d]pyrimidin-5-yl]phenyl]but-2-enamide
PubChem CID: 46212971
2D Structure
Properties
C32H31N5O3
Molecular Formula
533.60
Molecular Weight
g/mol
533.2427
Exact Mass
Da
4.9
XLogP
Drug-like (Lipinski: < 5)
104
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
7
H-Bond Acceptors
812
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
DBPR1121226549-49-0GozanertinibDBPR-112(E)-4-(dimethylamino)-N-[3-[4-[[(1S)-2-hydroxy-1-phenylethyl]amino]-6-phenylfuro[2,3-d]pyrimidin-5-yl]phenyl]but-2-enamideCHEMBL4521381(2E)-4-(Dimethylamino)-N-[3-[4-[[(1S)-2-hydroxy-1-phenylethyl]amino]-6-phenylfuro[2,3-d]pyrimidin-5-yl]phenyl]-2-butenamide(S,E)-4-(dimethylamino)-N-(3-(4-((2-hydroxy-1-phenylethyl)amino)-6-phenylfuro[2,3-d]pyrimidin-5-yl)phenyl)but-2-enamidegozanertinib [INN]CID 462129716G0COS33K4ABT101DBPR112?orb1709923SCHEMBL3316589
Data from PubChem (NCBI)
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