N-(3-chloro-4-methylphenyl)-2-[5-(3-chlorophenyl)-7-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2-[5-(3-chlorophenyl)-7-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
N-(3-chloro-4-methylphenyl)-2-[5-(3-chlorophenyl)-7-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | P032-1851 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-2-[5-(3-chlorophenyl)-7-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 442.3 |
| Molecular Formula: | C21 H17 Cl2 N5 O2 |
| Smiles: | CC1=CC2=NN(CC(Nc3ccc(C)c(c3)[Cl])=O)C(N2C(c2cccc(c2)[Cl])=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0823 |
| logD: | 5.0646 |
| logSw: | -5.4447 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.873 |
| InChI Key: | HMADHCDUSPZDIS-UHFFFAOYSA-N |