1-[5-({[4-(dimethylamino)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]-2-phenoxyethan-1-one
Chemical Structure Depiction of
1-[5-({[4-(dimethylamino)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]-2-phenoxyethan-1-one
1-[5-({[4-(dimethylamino)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]-2-phenoxyethan-1-one
Compound characteristics
| Compound ID: | D331-0235 |
| Compound Name: | 1-[5-({[4-(dimethylamino)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]-2-phenoxyethan-1-one |
| Molecular Weight: | 417.47 |
| Molecular Formula: | C23 H23 N5 O3 |
| Smiles: | CN(C)c1ccc(CNc2nc(c3ccco3)nn2C(COc2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2294 |
| logD: | 3.214 |
| logSw: | -3.4325 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.582 |
| InChI Key: | PHWFIHLGJQBNIO-UHFFFAOYSA-N |