N-(3-chlorophenyl)-2-[3-(3-methoxyphenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-2-[3-(3-methoxyphenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
N-(3-chlorophenyl)-2-[3-(3-methoxyphenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
Compound characteristics
| Compound ID: | C656-0551 |
| Compound Name: | N-(3-chlorophenyl)-2-[3-(3-methoxyphenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide |
| Molecular Weight: | 410.82 |
| Molecular Formula: | C19 H15 Cl N6 O3 |
| Smiles: | COc1cccc(c1)n1c2c(C(N(CC(Nc3cccc(c3)[Cl])=O)C=N2)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 2.8057 |
| logD: | 2.8056 |
| logSw: | -3.4078 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.851 |
| InChI Key: | NYLWGHOIQSDTBM-UHFFFAOYSA-N |