N-(3-chloro-4-methylphenyl)-2-(9-chloro-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2-(9-chloro-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide
N-(3-chloro-4-methylphenyl)-2-(9-chloro-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | F810-0273 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-2-(9-chloro-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide |
| Molecular Weight: | 402.24 |
| Molecular Formula: | C18 H13 Cl2 N5 O2 |
| Smiles: | Cc1ccc(cc1[Cl])NC(CN1C(N2C=Nc3ccc(cc3C2=N1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.155 |
| logD: | 4.1549 |
| logSw: | -4.3906 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.837 |
| InChI Key: | YZSIVWFRYUXOIK-UHFFFAOYSA-N |