2-[3-(3-chlorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]-N-(2,5-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[3-(3-chlorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]-N-(2,5-dimethoxyphenyl)acetamide
2-[3-(3-chlorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]-N-(2,5-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C656-0487 |
| Compound Name: | 2-[3-(3-chlorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]-N-(2,5-dimethoxyphenyl)acetamide |
| Molecular Weight: | 440.84 |
| Molecular Formula: | C20 H17 Cl N6 O4 |
| Smiles: | COc1ccc(c(c1)NC(CN1C=Nc2c(C1=O)nnn2c1cccc(c1)[Cl])=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.2112 |
| logD: | 2.2108 |
| logSw: | -3.2951 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.784 |
| InChI Key: | LMWZDIWNNDJRMD-UHFFFAOYSA-N |