[5-(benzylsulfanyl)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](3,4-dimethoxyphenyl)methanone
Chemical Structure Depiction of
[5-(benzylsulfanyl)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](3,4-dimethoxyphenyl)methanone
[5-(benzylsulfanyl)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](3,4-dimethoxyphenyl)methanone
Compound characteristics
| Compound ID: | 6529-0272 |
| Compound Name: | [5-(benzylsulfanyl)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](3,4-dimethoxyphenyl)methanone |
| Molecular Weight: | 421.47 |
| Molecular Formula: | C22 H19 N3 O4 S |
| Smiles: | COc1ccc(cc1OC)C(n1c(nc(c2ccco2)n1)SCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6978 |
| logD: | 3.6978 |
| logSw: | -4.0238 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.235 |
| InChI Key: | DKMUVRACUBBZIK-UHFFFAOYSA-N |