2-[3-(3-chlorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]-N-(2-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-(2-fluorophenyl)acetamide
2-[3-(3-chlorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]-N-(2-fluorophenyl)acetamide
Compound characteristics
Compound ID: | C656-0478 |
Compound Name: | 2-[3-(3-chlorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]-N-(2-fluorophenyl)acetamide |
Molecular Weight: | 398.78 |
Molecular Formula: | C18 H12 Cl F N6 O2 |
Smiles: | C(C(Nc1ccccc1F)=O)N1C=Nc2c(C1=O)nnn2c1cccc(c1)[Cl] |
Stereo: | ACHIRAL |
logP: | 2.3079 |
logD: | 2.3078 |
logSw: | -3.3816 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 75.61 |
InChI Key: | FPABOZONFFSMAX-UHFFFAOYSA-N |