ethyl 2-butanamido-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-butanamido-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
ethyl 2-butanamido-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y500-7794 |
| Compound Name: | ethyl 2-butanamido-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate |
| Molecular Weight: | 323.45 |
| Molecular Formula: | C17 H25 N O3 S |
| Smiles: | CCCC(Nc1c(C(=O)OCC)c2CCCCCCc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4597 |
| logD: | 2.136 |
| logSw: | -4.3407 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.187 |
| InChI Key: | SBKRKKFAPNCECY-UHFFFAOYSA-N |