N-[(2-chlorophenyl)methyl]-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-[(2-chlorophenyl)methyl]-2-[3-(4-fluorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
N-[(2-chlorophenyl)methyl]-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: | C656-0429 |
Compound Name: | N-[(2-chlorophenyl)methyl]-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: | C(c1ccccc1[Cl])NC(CN1C=Nc2c(C1=O)nnn2c1ccc(cc1)F)=O |
Stereo: | ACHIRAL |
logP: | 2.2821 |
logD: | 2.2821 |
logSw: | -3.0544 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 77.63 |
InChI Key: | LUVADGCEFBXGIT-UHFFFAOYSA-N |