2-{[(3,4-dimethoxyphenyl)methyl]sulfanyl}-1,3-benzothiazole
Chemical Structure Depiction of
2-{[(3,4-dimethoxyphenyl)methyl]sulfanyl}-1,3-benzothiazole
2-{[(3,4-dimethoxyphenyl)methyl]sulfanyl}-1,3-benzothiazole
Compound characteristics
| Compound ID: | 5786-2132 |
| Compound Name: | 2-{[(3,4-dimethoxyphenyl)methyl]sulfanyl}-1,3-benzothiazole |
| Molecular Weight: | 317.43 |
| Molecular Formula: | C16 H15 N O2 S2 |
| Smiles: | COc1ccc(CSc2nc3ccccc3s2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.3743 |
| logD: | 4.3743 |
| logSw: | -4.4497 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.3092 |
| InChI Key: | POJHJZHJCMZRCS-UHFFFAOYSA-N |