N-(3-chloro-4-methylphenyl)-2-[3-(4-fluorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2-[3-(4-fluorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
N-(3-chloro-4-methylphenyl)-2-[3-(4-fluorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
Compound characteristics
| Compound ID: | C656-0408 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-2-[3-(4-fluorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide |
| Molecular Weight: | 412.81 |
| Molecular Formula: | C19 H14 Cl F N6 O2 |
| Smiles: | Cc1ccc(cc1[Cl])NC(CN1C=Nc2c(C1=O)nnn2c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3125 |
| logD: | 3.3124 |
| logSw: | -3.4562 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.308 |
| InChI Key: | NYRDMFOXNOMKPJ-UHFFFAOYSA-N |