1-[(2-chlorophenyl)methyl]-N-[(3,5-difluorophenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-[(2-chlorophenyl)methyl]-N-[(3,5-difluorophenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
1-[(2-chlorophenyl)methyl]-N-[(3,5-difluorophenyl)methyl]-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L116-4520 |
| Compound Name: | 1-[(2-chlorophenyl)methyl]-N-[(3,5-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(c1cc(cc(c1)F)F)NC(c1c(n2cccc2)n(Cc2ccccc2[Cl])nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5501 |
| logD: | 4.5501 |
| logSw: | -4.555 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.15 |
| InChI Key: | DHWHSMNKWCDQLS-UHFFFAOYSA-N |