ethyl 2-(4-bromobenzamido)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(4-bromobenzamido)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
ethyl 2-(4-bromobenzamido)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Compound characteristics
| Compound ID: | 3966-1214 |
| Compound Name: | ethyl 2-(4-bromobenzamido)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate |
| Molecular Weight: | 438.34 |
| Molecular Formula: | C19 H20 Br N O4 S |
| Smiles: | CCOC(c1c2CC(C)(C)OCc2sc1NC(c1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.817 |
| logD: | 0.222 |
| logSw: | -4.8515 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.495 |
| InChI Key: | LCYQNLDWQPJOTP-UHFFFAOYSA-N |