2,4-dimethoxy-6-(phenylmethanesulfinyl)benzonitrile
Chemical Structure Depiction of
2,4-dimethoxy-6-(phenylmethanesulfinyl)benzonitrile
2,4-dimethoxy-6-(phenylmethanesulfinyl)benzonitrile
Compound characteristics
| Compound ID: | 8012-3305 |
| Compound Name: | 2,4-dimethoxy-6-(phenylmethanesulfinyl)benzonitrile |
| Molecular Weight: | 301.36 |
| Molecular Formula: | C16 H15 N O3 S |
| Smiles: | COc1cc(c(C#N)c(c1)S(Cc1ccccc1)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.2507 |
| logD: | 2.2507 |
| logSw: | -2.5827 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.609 |
| InChI Key: | AKRWRLIBHHYACU-UHFFFAOYSA-N |