1-[(4-methoxyphenyl)methyl]-5-(1H-pyrrol-1-yl)-N-[4-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-[(4-methoxyphenyl)methyl]-5-(1H-pyrrol-1-yl)-N-[4-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxamide
1-[(4-methoxyphenyl)methyl]-5-(1H-pyrrol-1-yl)-N-[4-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L116-2457 |
| Compound Name: | 1-[(4-methoxyphenyl)methyl]-5-(1H-pyrrol-1-yl)-N-[4-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 441.41 |
| Molecular Formula: | C22 H18 F3 N5 O2 |
| Smiles: | COc1ccc(Cn2c(c(C(Nc3ccc(cc3)C(F)(F)F)=O)nn2)n2cccc2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6247 |
| logD: | 4.6247 |
| logSw: | -4.3407 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.372 |
| InChI Key: | PDCLPINSBVKURM-UHFFFAOYSA-N |