N-(3,4-dichlorophenyl)-2-(5-methyl-3-oxo-7-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide
Chemical Structure Depiction of
N-(3,4-dichlorophenyl)-2-(5-methyl-3-oxo-7-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide
N-(3,4-dichlorophenyl)-2-(5-methyl-3-oxo-7-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | P032-2104 |
| Compound Name: | N-(3,4-dichlorophenyl)-2-(5-methyl-3-oxo-7-phenyl[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl)acetamide |
| Molecular Weight: | 428.28 |
| Molecular Formula: | C20 H15 Cl2 N5 O2 |
| Smiles: | CC1=NC(=CC2=NN(CC(Nc3ccc(c(c3)[Cl])[Cl])=O)C(N12)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4082 |
| logD: | 4.3953 |
| logSw: | -4.5007 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.139 |
| InChI Key: | ZYXBZFIJQOUZGO-UHFFFAOYSA-N |