ethyl 2-(3-methylbutanamido)-5,7-diphenyl-4,7-dihydro-5H-thieno[2,3-c]thiopyran-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(3-methylbutanamido)-5,7-diphenyl-4,7-dihydro-5H-thieno[2,3-c]thiopyran-3-carboxylate
ethyl 2-(3-methylbutanamido)-5,7-diphenyl-4,7-dihydro-5H-thieno[2,3-c]thiopyran-3-carboxylate
Compound characteristics
| Compound ID: | 6030-1637 |
| Compound Name: | ethyl 2-(3-methylbutanamido)-5,7-diphenyl-4,7-dihydro-5H-thieno[2,3-c]thiopyran-3-carboxylate |
| Molecular Weight: | 479.66 |
| Molecular Formula: | C27 H29 N O3 S2 |
| Smiles: | CCOC(c1c2CC(c3ccccc3)SC(c3ccccc3)c2sc1NC(CC(C)C)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.1235 |
| logD: | 5.2637 |
| logSw: | -5.8296 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.313 |
| InChI Key: | YCAXOZNSFVNYDO-UHFFFAOYSA-N |