N-(4-chloro-2-methoxy-5-methylphenyl)-2-(9-methyl-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide
Chemical Structure Depiction of
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(9-methyl-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(9-methyl-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | F810-0134 |
| Compound Name: | N-(4-chloro-2-methoxy-5-methylphenyl)-2-(9-methyl-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide |
| Molecular Weight: | 411.85 |
| Molecular Formula: | C20 H18 Cl N5 O3 |
| Smiles: | Cc1ccc2c(c1)C1=NN(CC(Nc3cc(C)c(cc3OC)[Cl])=O)C(N1C=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4414 |
| logD: | 3.4405 |
| logSw: | -3.7346 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.769 |
| InChI Key: | BMYNOKJMDXOHEI-UHFFFAOYSA-N |