N-(3-chlorophenyl)-3-[2-(4-chlorophenyl)-4,5-dimethyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-3-[2-(4-chlorophenyl)-4,5-dimethyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide
N-(3-chlorophenyl)-3-[2-(4-chlorophenyl)-4,5-dimethyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide
Compound characteristics
| Compound ID: | D527-1023 |
| Compound Name: | N-(3-chlorophenyl)-3-[2-(4-chlorophenyl)-4,5-dimethyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanamide |
| Molecular Weight: | 456.33 |
| Molecular Formula: | C22 H19 Cl2 N5 O2 |
| Smiles: | [H]C([H])([H])N1C(C)=C(CCC(Nc2cccc(c2)[Cl])=O)C(n2c1nc(c1ccc(cc1)[Cl])n2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6876 |
| logD: | 4.6866 |
| logSw: | -4.7638 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.398 |
| InChI Key: | NWPUETJJLNUERW-UHFFFAOYSA-N |