1-(3-chlorophenyl)-N-[4-(dimethylamino)phenyl]-5-phenyl-1H-1,2,4-triazole-3-carboxamide
Chemical Structure Depiction of
1-(3-chlorophenyl)-N-[4-(dimethylamino)phenyl]-5-phenyl-1H-1,2,4-triazole-3-carboxamide
1-(3-chlorophenyl)-N-[4-(dimethylamino)phenyl]-5-phenyl-1H-1,2,4-triazole-3-carboxamide
Compound characteristics
| Compound ID: | D351-2225 |
| Compound Name: | 1-(3-chlorophenyl)-N-[4-(dimethylamino)phenyl]-5-phenyl-1H-1,2,4-triazole-3-carboxamide |
| Molecular Weight: | 417.9 |
| Molecular Formula: | C23 H20 Cl N5 O |
| Smiles: | CN(C)c1ccc(cc1)NC(c1nc(c2ccccc2)n(c2cccc(c2)[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4624 |
| logD: | 5.4539 |
| logSw: | -5.9326 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.785 |
| InChI Key: | VUZVXEQNYQUUTD-UHFFFAOYSA-N |