3-(4-methoxyphenyl)-5-oxo-N-[(pyridin-2-yl)methyl]-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
Chemical Structure Depiction of
3-(4-methoxyphenyl)-5-oxo-N-[(pyridin-2-yl)methyl]-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
3-(4-methoxyphenyl)-5-oxo-N-[(pyridin-2-yl)methyl]-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
Compound characteristics
Compound ID: | E543-0687 |
Compound Name: | 3-(4-methoxyphenyl)-5-oxo-N-[(pyridin-2-yl)methyl]-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide |
Molecular Weight: | 426.43 |
Molecular Formula: | C23 H18 N6 O3 |
Smiles: | COc1ccc(cc1)c1c2NC(c3ccc(cc3n2nn1)C(NCc1ccccn1)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.0579 |
logD: | 2.0577 |
logSw: | -3.1006 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 91.731 |
InChI Key: | QJKWDHRRYJCPSO-UHFFFAOYSA-N |