1-[(3-chlorophenyl)methyl]-N-[(2,4-difluorophenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-[(3-chlorophenyl)methyl]-N-[(2,4-difluorophenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
1-[(3-chlorophenyl)methyl]-N-[(2,4-difluorophenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
Compound ID: | L116-4711 |
Compound Name: | 1-[(3-chlorophenyl)methyl]-N-[(2,4-difluorophenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide |
Molecular Weight: | 427.84 |
Molecular Formula: | C21 H16 Cl F2 N5 O |
Smiles: | C(c1ccc(cc1F)F)NC(c1c(n2cccc2)n(Cc2cccc(c2)[Cl])nn1)=O |
Stereo: | ACHIRAL |
logP: | 4.4302 |
logD: | 4.4302 |
logSw: | -4.6155 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.15 |
InChI Key: | BFWPRJVSXHIZCG-UHFFFAOYSA-N |