N-(4-chloro-2-methylphenyl)-1-[(2-chlorophenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(4-chloro-2-methylphenyl)-1-[(2-chlorophenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
N-(4-chloro-2-methylphenyl)-1-[(2-chlorophenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L116-1830 |
| Compound Name: | N-(4-chloro-2-methylphenyl)-1-[(2-chlorophenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 426.3 |
| Molecular Formula: | C21 H17 Cl2 N5 O |
| Smiles: | Cc1cc(ccc1NC(c1c(n2cccc2)n(Cc2ccccc2[Cl])nn1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.4847 |
| logD: | 5.4846 |
| logSw: | -5.8512 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.13 |
| InChI Key: | VRFQZAHKUQKEBY-UHFFFAOYSA-N |