1-[(4-chlorophenyl)methyl]-N-[(pyridin-2-yl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-[(4-chlorophenyl)methyl]-N-[(pyridin-2-yl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
1-[(4-chlorophenyl)methyl]-N-[(pyridin-2-yl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L116-4603 |
| Compound Name: | 1-[(4-chlorophenyl)methyl]-N-[(pyridin-2-yl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 392.85 |
| Molecular Formula: | C20 H17 Cl N6 O |
| Smiles: | C(c1ccccn1)NC(c1c(n2cccc2)n(Cc2ccc(cc2)[Cl])nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0458 |
| logD: | 3.0454 |
| logSw: | -3.5017 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.693 |
| InChI Key: | PLZVXYOKQQJVHF-UHFFFAOYSA-N |