5-oxo-3-phenyl-N-[(thiophen-2-yl)methyl]-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
Chemical Structure Depiction of
5-oxo-3-phenyl-N-[(thiophen-2-yl)methyl]-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
5-oxo-3-phenyl-N-[(thiophen-2-yl)methyl]-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | E543-0003 |
| Compound Name: | 5-oxo-3-phenyl-N-[(thiophen-2-yl)methyl]-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide |
| Molecular Weight: | 401.44 |
| Molecular Formula: | C21 H15 N5 O2 S |
| Smiles: | C(c1cccs1)NC(c1ccc2C(Nc3c(c4ccccc4)nnn3c2c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8553 |
| logD: | 2.8552 |
| logSw: | -3.7192 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.662 |
| InChI Key: | AQHINVCBKXONQL-UHFFFAOYSA-N |