1-[(4-methylphenyl)methyl]-N-[(pyridin-3-yl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-[(4-methylphenyl)methyl]-N-[(pyridin-3-yl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
1-[(4-methylphenyl)methyl]-N-[(pyridin-3-yl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L116-4952 |
| Compound Name: | 1-[(4-methylphenyl)methyl]-N-[(pyridin-3-yl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 372.43 |
| Molecular Formula: | C21 H20 N6 O |
| Smiles: | Cc1ccc(Cn2c(c(C(NCc3cccnc3)=O)nn2)n2cccc2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.5565 |
| logD: | 2.5564 |
| logSw: | -2.2267 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.668 |
| InChI Key: | NPIWVHPQUODSII-UHFFFAOYSA-N |