N-(3-fluoro-4-methylphenyl)-1-[(4-methoxyphenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(3-fluoro-4-methylphenyl)-1-[(4-methoxyphenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
N-(3-fluoro-4-methylphenyl)-1-[(4-methoxyphenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L116-2459 |
| Compound Name: | N-(3-fluoro-4-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: | Cc1ccc(cc1F)NC(c1c(n2cccc2)n(Cc2ccc(cc2)OC)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4017 |
| logD: | 4.4016 |
| logSw: | -4.3559 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.372 |
| InChI Key: | GBTCNQGNWNBQSF-UHFFFAOYSA-N |