2-(3,4-dimethylphenyl)-N-[(4-fluorophenyl)methyl]-5-(hydroxymethyl)-2H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
2-(3,4-dimethylphenyl)-N-[(4-fluorophenyl)methyl]-5-(hydroxymethyl)-2H-1,2,3-triazole-4-carboxamide
2-(3,4-dimethylphenyl)-N-[(4-fluorophenyl)methyl]-5-(hydroxymethyl)-2H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | D217-0488 |
| Compound Name: | 2-(3,4-dimethylphenyl)-N-[(4-fluorophenyl)methyl]-5-(hydroxymethyl)-2H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 354.38 |
| Molecular Formula: | C19 H19 F N4 O2 |
| Smiles: | Cc1ccc(cc1C)n1nc(CO)c(C(NCc2ccc(cc2)F)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.7812 |
| logD: | 2.7811 |
| logSw: | -2.9695 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.136 |
| InChI Key: | CXSXYTPGKFAKOZ-UHFFFAOYSA-N |