N-(3-chloro-4-methoxyphenyl)-2-(9-methyl-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-(9-methyl-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide
N-(3-chloro-4-methoxyphenyl)-2-(9-methyl-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | F810-0113 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-(9-methyl-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide |
| Molecular Weight: | 397.82 |
| Molecular Formula: | C19 H16 Cl N5 O3 |
| Smiles: | Cc1ccc2c(c1)C1=NN(CC(Nc3ccc(c(c3)[Cl])OC)=O)C(N1C=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0011 |
| logD: | 3.0007 |
| logSw: | -3.3916 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.467 |
| InChI Key: | NIEOPQXYQYOQAX-UHFFFAOYSA-N |