3-(3,4-dimethoxyphenyl)-7,8-dimethyl-1,5-dihydro-3H-2,4-benzodithiepine
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-7,8-dimethyl-1,5-dihydro-3H-2,4-benzodithiepine
3-(3,4-dimethoxyphenyl)-7,8-dimethyl-1,5-dihydro-3H-2,4-benzodithiepine
Compound characteristics
| Compound ID: | 8009-9706 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-7,8-dimethyl-1,5-dihydro-3H-2,4-benzodithiepine |
| Molecular Weight: | 346.51 |
| Molecular Formula: | C19 H22 O2 S2 |
| Smiles: | Cc1cc2CSC(c3ccc(c(c3)OC)OC)SCc2cc1C |
| Stereo: | ACHIRAL |
| logP: | 5.4898 |
| logD: | 5.4898 |
| logSw: | -5.6626 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 15.4793 |
| InChI Key: | GTEPWIGDOGADHK-UHFFFAOYSA-N |