1-[5-({[4-(dimethylamino)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]-2-(naphthalen-1-yl)ethan-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-(naphthalen-1-yl)ethan-1-one
1-[5-({[4-(dimethylamino)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]-2-(naphthalen-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | D331-0275 |
| Compound Name: | 1-[5-({[4-(dimethylamino)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]-2-(naphthalen-1-yl)ethan-1-one |
| Molecular Weight: | 451.53 |
| Molecular Formula: | C27 H25 N5 O2 |
| Smiles: | CN(C)c1ccc(CNc2nc(c3ccco3)nn2C(Cc2cccc3ccccc23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7164 |
| logD: | 4.6622 |
| logSw: | -5.2684 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.811 |
| InChI Key: | YCWJVKYCXKKEBU-UHFFFAOYSA-N |