N-(3-chloro-4-fluorophenyl)-2-[7-(4-methoxyphenyl)-5-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-[7-(4-methoxyphenyl)-5-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
N-(3-chloro-4-fluorophenyl)-2-[7-(4-methoxyphenyl)-5-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
Compound ID: | P032-3030 |
Compound Name: | N-(3-chloro-4-fluorophenyl)-2-[7-(4-methoxyphenyl)-5-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide |
Molecular Weight: | 441.85 |
Molecular Formula: | C21 H17 Cl F N5 O3 |
Smiles: | CC1=NC(=CC2=NN(CC(Nc3ccc(c(c3)[Cl])F)=O)C(N12)=O)c1ccc(cc1)OC |
Stereo: | ACHIRAL |
logP: | 3.7515 |
logD: | 3.7412 |
logSw: | -4.2729 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.682 |
InChI Key: | GZBHLSGIZQNTHW-UHFFFAOYSA-N |