1-[(3-chlorophenyl)methyl]-N-(2-phenylethyl)-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-[(3-chlorophenyl)methyl]-N-(2-phenylethyl)-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
1-[(3-chlorophenyl)methyl]-N-(2-phenylethyl)-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L116-4722 |
| Compound Name: | 1-[(3-chlorophenyl)methyl]-N-(2-phenylethyl)-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 405.89 |
| Molecular Formula: | C22 H20 Cl N5 O |
| Smiles: | C(CNC(c1c(n2cccc2)n(Cc2cccc(c2)[Cl])nn1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9499 |
| logD: | 3.9499 |
| logSw: | -4.4051 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.992 |
| InChI Key: | URIIJSCTHHYNBF-UHFFFAOYSA-N |