N-(2,5-difluorophenyl)-1-[(4-methylphenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(2,5-difluorophenyl)-1-[(4-methylphenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
N-(2,5-difluorophenyl)-1-[(4-methylphenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L116-2160 |
| Compound Name: | N-(2,5-difluorophenyl)-1-[(4-methylphenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 393.39 |
| Molecular Formula: | C21 H17 F2 N5 O |
| Smiles: | Cc1ccc(Cn2c(c(C(Nc3cc(ccc3F)F)=O)nn2)n2cccc2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5585 |
| logD: | 4.5487 |
| logSw: | -4.2583 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.13 |
| InChI Key: | KPPLRMGIKSIKTD-UHFFFAOYSA-N |