1-[(4-methylphenyl)methyl]-5-(1H-pyrrol-1-yl)-N-{[2-(trifluoromethyl)phenyl]methyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-[(4-methylphenyl)methyl]-5-(1H-pyrrol-1-yl)-N-{[2-(trifluoromethyl)phenyl]methyl}-1H-1,2,3-triazole-4-carboxamide
1-[(4-methylphenyl)methyl]-5-(1H-pyrrol-1-yl)-N-{[2-(trifluoromethyl)phenyl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L116-4931 |
| Compound Name: | 1-[(4-methylphenyl)methyl]-5-(1H-pyrrol-1-yl)-N-{[2-(trifluoromethyl)phenyl]methyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 439.44 |
| Molecular Formula: | C23 H20 F3 N5 O |
| Smiles: | Cc1ccc(Cn2c(c(C(NCc3ccccc3C(F)(F)F)=O)nn2)n2cccc2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8346 |
| logD: | 4.8346 |
| logSw: | -4.5222 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.15 |
| InChI Key: | SUAOITLMVMDGBK-UHFFFAOYSA-N |