N-butyl-1-(2-chlorophenyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-carboxamide
Chemical Structure Depiction of
N-butyl-1-(2-chlorophenyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-carboxamide
N-butyl-1-(2-chlorophenyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-carboxamide
Compound characteristics
| Compound ID: | D351-2799 |
| Compound Name: | N-butyl-1-(2-chlorophenyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-carboxamide |
| Molecular Weight: | 384.86 |
| Molecular Formula: | C20 H21 Cl N4 O2 |
| Smiles: | CCCCNC(c1nc(c2ccc(cc2)OC)n(c2ccccc2[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7271 |
| logD: | 4.7271 |
| logSw: | -4.871 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.658 |
| InChI Key: | XWNWKSHPKHUAQJ-UHFFFAOYSA-N |