Ervogastat
2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]-N-[(3S)-oxolan-3-yl]pyrimidine-5-carboxamide
Molecular Identity
Ervogastat
2-[5-[(3-ethoxy-2-pyridinyl)oxy]-3-pyridinyl]-N-[(3S)-oxolan-3-yl]pyrimidine-5-carboxamide
PubChem CID: 134262752
2D Structure
Properties
C21H21N5O4
Molecular Formula
407.40
Molecular Weight
g/mol
407.1594
Exact Mass
Da
1.3
XLogP
Drug-like (Lipinski: < 5)
108
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
8
H-Bond Acceptors
545
Complexity
SMILES
Canonical SMILES
SMILES: CCOC1=C(N=CC=C1)OC2=CN=CC(=C2)C3=NC=C(C=N3)C(=O)NC4CCOC4Isomeric SMILES
SMILES: CCOC1=C(N=CC=C1)OC2=CN=CC(=C2)C3=NC=C(C=N3)C(=O)N[C@H]4CCOC4Synonyms(20)
Ervogastat2186700-33-2BSOIY5AKQWPF-068655712-(5-(3-ethoxypyridin-2-yl)oxypyridin-3-yl)-N-((3S)-oxolan-3-yl)pyrimidine-5-carboxamide2-[5-(3-ethoxypyridin-2-yl)oxypyridin-3-yl]-N-[(3S)-oxolan-3-yl]pyrimidine-5-carboxamideRefChem:137676Ervogastat [INN]UNII-BSOIY5AKQWUS10071992, Example 1US10071992, Example 3.4AKOS040759712PF06865571(S)-2-(5-((3-ethoxypyridin-2-yl)oxy)pyridin-3-yl)-N-(tetrahydrofuran-3-yl)pyrimidine-5-carboxamide2-(5-((3-Ethoxypyridin-2-yl)oxy)pyridin-3-yl)-N-((3S)-oxolan3-yl)pyrimidine-5-carboxamide
Data from PubChem (NCBI)
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