1-[(4-fluorophenyl)methyl]-N-[(4-methylphenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-[(4-fluorophenyl)methyl]-N-[(4-methylphenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
1-[(4-fluorophenyl)methyl]-N-[(4-methylphenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
Compound ID: | L116-4979 |
Compound Name: | 1-[(4-fluorophenyl)methyl]-N-[(4-methylphenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide |
Molecular Weight: | 389.43 |
Molecular Formula: | C22 H20 F N5 O |
Smiles: | Cc1ccc(CNC(c2c(n3cccc3)n(Cc3ccc(cc3)F)nn2)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.8133 |
logD: | 3.8133 |
logSw: | -3.842 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.15 |
InChI Key: | AIADRIWCOHYZSF-UHFFFAOYSA-N |