methyl 2-(2-chlorobenzamido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-(2-chlorobenzamido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
methyl 2-(2-chlorobenzamido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8009-4502 |
| Compound Name: | methyl 2-(2-chlorobenzamido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate |
| Molecular Weight: | 377.89 |
| Molecular Formula: | C19 H20 Cl N O3 S |
| Smiles: | COC(c1c2CCCCCCc2sc1NC(c1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2042 |
| logD: | 0.6299 |
| logSw: | -5.5591 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.549 |
| InChI Key: | SOWGHSFAGLWMLE-UHFFFAOYSA-N |