Olutasidenib
5-[[(1S)-1-(6-chloro-2-oxo-1H-quinolin-3-yl)ethyl]amino]-1-methyl-6-oxopyridine-2-carbonitrile
Molecular Identity
Olutasidenib
5-[[(1S)-1-(6-chloro-2-oxo-1H-quinolin-3-yl)ethyl]amino]-1-methyl-6-oxopyridine-2-carbonitrile
PubChem CID: 118955396
2D Structure
Properties
C18H15ClN4O2
Molecular Formula
354.80
Molecular Weight
g/mol
354.0884
Exact Mass
Da
2.5
XLogP
Drug-like (Lipinski: < 5)
85.2
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
4
H-Bond Acceptors
745
Complexity
SMILES
Canonical SMILES
SMILES: CC(C1=CC2=C(C=CC(=C2)Cl)NC1=O)NC3=CC=C(N(C3=O)C)C#NIsomeric SMILES
SMILES: C[C@@H](C1=CC2=C(C=CC(=C2)Cl)NC1=O)NC3=CC=C(N(C3=O)C)C#NSynonyms(20)
Olutasidenib1887014-12-1FT-2102Rezlidhia0T4IMT8S5Z5-[[(1S)-1-(6-chloro-2-oxo-1H-quinolin-3-yl)ethyl]amino]-1-methyl-6-oxopyridine-2-carbonitrile(S)-5-((1-(6-chloro-2-oxo-1,2-dihydroquinolin-3-yl)ethyl)amino)-1-methyl-6-oxo-1,6-dihydropyridine-2-carbonitrile5-{[(1S)-1-(6-chloro-2-oxo-1,2-dihydroquinolin-3-yl)ethyl]amino}-1-methyl-6-oxo-1,6-dihydropyridine-2-carbonitrile2-Pyridinecarbonitrile, 5-(((1S)-1-(6-chloro-1,2-dihydro-2-oxo-3-quinolinyl)ethyl)amino)-1,6-dihydro-1-methyl-6-oxo-5-(((1S)-1-(6-chloro-2-oxo-1,2-dihydroquinolin-3-yl)ethyl)amino)-1-methyl-6-oxo-1,6-dihydropyridine-2-carbonitrileolutasidenibum5-(((1S)-1-(6-chloro-2-oxo-1H-quinolin-3-yl)ethyl)amino)-1-methyl-6-oxopyridine-2-carbonitrileRefChem:57416IDH1-R132 Inhibitor FT-2102FT 2102
Data from PubChem (NCBI)
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