N-benzyl-3-(4-chlorophenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
Chemical Structure Depiction of
N-benzyl-3-(4-chlorophenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
N-benzyl-3-(4-chlorophenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide
Compound characteristics
| Compound ID: | E543-0295 |
| Compound Name: | N-benzyl-3-(4-chlorophenyl)-5-oxo-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-8-carboxamide |
| Molecular Weight: | 429.86 |
| Molecular Formula: | C23 H16 Cl N5 O2 |
| Smiles: | C(c1ccccc1)NC(c1ccc2C(Nc3c(c4ccc(cc4)[Cl])nnn3c2c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5801 |
| logD: | 3.58 |
| logSw: | -4.2256 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.644 |
| InChI Key: | SETJMKRNRPRBCD-UHFFFAOYSA-N |