N-(4-fluoro-2-methylphenyl)-1-[(4-methoxyphenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(4-fluoro-2-methylphenyl)-1-[(4-methoxyphenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
N-(4-fluoro-2-methylphenyl)-1-[(4-methoxyphenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L116-2460 |
| Compound Name: | N-(4-fluoro-2-methylphenyl)-1-[(4-methoxyphenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 405.43 |
| Molecular Formula: | C22 H20 F N5 O2 |
| Smiles: | Cc1cc(ccc1NC(c1c(n2cccc2)n(Cc2ccc(cc2)OC)nn1)=O)F |
| Stereo: | ACHIRAL |
| logP: | 3.9691 |
| logD: | 3.969 |
| logSw: | -4.0928 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.674 |
| InChI Key: | WWHLRCZLOATHKY-UHFFFAOYSA-N |