N-[(4-ethylphenyl)methyl]-3-(3-fluorophenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
Chemical Structure Depiction of
N-[(4-ethylphenyl)methyl]-3-(3-fluorophenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
N-[(4-ethylphenyl)methyl]-3-(3-fluorophenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | E543-0684 |
| Compound Name: | N-[(4-ethylphenyl)methyl]-3-(3-fluorophenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide |
| Molecular Weight: | 441.46 |
| Molecular Formula: | C25 H20 F N5 O2 |
| Smiles: | CCc1ccc(CNC(c2ccc3C(Nc4c(c5cccc(c5)F)nnn4c3c2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1252 |
| logD: | 4.1244 |
| logSw: | -4.2232 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.644 |
| InChI Key: | PWSDBJGROAFOIE-UHFFFAOYSA-N |