propyl 2-(2,2-dimethylpropanamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
propyl 2-(2,2-dimethylpropanamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
propyl 2-(2,2-dimethylpropanamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y500-5148 |
| Compound Name: | propyl 2-(2,2-dimethylpropanamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate |
| Molecular Weight: | 337.48 |
| Molecular Formula: | C18 H27 N O3 S |
| Smiles: | CCCOC(c1c2CCCCCc2sc1NC(C(C)(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7382 |
| logD: | 2.1069 |
| logSw: | -4.6105 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.695 |
| InChI Key: | LBWPSANUFVGMEV-UHFFFAOYSA-N |