N-butyl-1-(4-chlorophenyl)-5-propyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-butyl-1-(4-chlorophenyl)-5-propyl-1H-1,2,3-triazole-4-carboxamide
N-butyl-1-(4-chlorophenyl)-5-propyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | D731-0448 |
| Compound Name: | N-butyl-1-(4-chlorophenyl)-5-propyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 320.82 |
| Molecular Formula: | C16 H21 Cl N4 O |
| Smiles: | CCCCNC(c1c(CCC)n(c2ccc(cc2)[Cl])nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8906 |
| logD: | 3.8906 |
| logSw: | -4.3249 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.118 |
| InChI Key: | PRILZEPWGWNPCN-UHFFFAOYSA-N |