2-(5-anilino-7-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)-N-(5-chloro-2-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-(5-anilino-7-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)-N-(5-chloro-2-methoxyphenyl)acetamide
2-(5-anilino-7-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)-N-(5-chloro-2-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | P572-4615 |
| Compound Name: | 2-(5-anilino-7-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)-N-(5-chloro-2-methoxyphenyl)acetamide |
| Molecular Weight: | 438.87 |
| Molecular Formula: | C21 H19 Cl N6 O3 |
| Smiles: | CC1=CC2=NN(CC(Nc3cc(ccc3OC)[Cl])=O)C(N2C(Nc2ccccc2)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1799 |
| logD: | 3.1789 |
| logSw: | -3.5094 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.727 |
| InChI Key: | NVSRWUIKAPCQBU-UHFFFAOYSA-N |