2-[3-(3-chlorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]-N-(4-fluorophenyl)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-(4-fluorophenyl)acetamide
2-[3-(3-chlorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]-N-(4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | C656-0480 |
| Compound Name: | 2-[3-(3-chlorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]-N-(4-fluorophenyl)acetamide |
| Molecular Weight: | 398.78 |
| Molecular Formula: | C18 H12 Cl F N6 O2 |
| Smiles: | C(C(Nc1ccc(cc1)F)=O)N1C=Nc2c(C1=O)nnn2c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.5568 |
| logD: | 2.5567 |
| logSw: | -3.3941 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.308 |
| InChI Key: | MMUHWHKJYWQRJL-UHFFFAOYSA-N |