N-(5-chloro-2-methylphenyl)-2-(9-chloro-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide
Chemical Structure Depiction of
N-(5-chloro-2-methylphenyl)-2-(9-chloro-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide
N-(5-chloro-2-methylphenyl)-2-(9-chloro-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | F810-0227 |
| Compound Name: | N-(5-chloro-2-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(cc1NC(CN1C(N2C=Nc3ccc(cc3C2=N1)[Cl])=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.222 |
| logD: | 3.2219 |
| logSw: | -3.5564 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.139 |
| InChI Key: | FMMVURBNMDEIJY-UHFFFAOYSA-N |