9-(4-methoxyphenyl)-3,4a,5,6,7,8,8a,9-octahydro-2H-5,8-methano[1]benzothiopyrano[2,3-d][1,3]thiazole-2-thione
Chemical Structure Depiction of
9-(4-methoxyphenyl)-3,4a,5,6,7,8,8a,9-octahydro-2H-5,8-methano[1]benzothiopyrano[2,3-d][1,3]thiazole-2-thione
9-(4-methoxyphenyl)-3,4a,5,6,7,8,8a,9-octahydro-2H-5,8-methano[1]benzothiopyrano[2,3-d][1,3]thiazole-2-thione
Compound characteristics
| Compound ID: | D057-0283 |
| Compound Name: | 9-(4-methoxyphenyl)-3,4a,5,6,7,8,8a,9-octahydro-2H-5,8-methano[1]benzothiopyrano[2,3-d][1,3]thiazole-2-thione |
| Molecular Weight: | 361.55 |
| Molecular Formula: | C18 H19 N O S3 |
| Smiles: | COc1ccc(cc1)C1C2C3CCC(C3)C2SC2=C1SC(N2)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1054 |
| logD: | 5.0964 |
| logSw: | -5.0015 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 18.3307 |
| InChI Key: | SOLFGTIEYURABM-UHFFFAOYSA-N |