[5-{[(3,4-dimethoxyphenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](naphthalen-1-yl)methanone
Chemical Structure Depiction of
[5-{[(3,4-dimethoxyphenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](naphthalen-1-yl)methanone
[5-{[(3,4-dimethoxyphenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](naphthalen-1-yl)methanone
Compound characteristics
| Compound ID: | D331-0217 |
| Compound Name: | [5-{[(3,4-dimethoxyphenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](naphthalen-1-yl)methanone |
| Molecular Weight: | 454.48 |
| Molecular Formula: | C26 H22 N4 O4 |
| Smiles: | COc1ccc(CNc2nc(c3ccco3)nn2C(c2cccc3ccccc23)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.0038 |
| logD: | 4.0038 |
| logSw: | -4.1592 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.795 |
| InChI Key: | BSJZCLPENBIWIX-UHFFFAOYSA-N |