N-[(4-ethylphenyl)methyl]-1-[(4-fluorophenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-[(4-ethylphenyl)methyl]-1-[(4-fluorophenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
N-[(4-ethylphenyl)methyl]-1-[(4-fluorophenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L116-4980 |
| Compound Name: | N-[(4-ethylphenyl)methyl]-1-[(4-fluorophenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 403.46 |
| Molecular Formula: | C23 H22 F N5 O |
| Smiles: | CCc1ccc(CNC(c2c(n3cccc3)n(Cc3ccc(cc3)F)nn2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3206 |
| logD: | 4.3206 |
| logSw: | -4.1607 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.15 |
| InChI Key: | VYZOYPOWUJZFCC-UHFFFAOYSA-N |