ethyl 2-[2-(4-chloro-2-methylphenoxy)propanamido]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[2-(4-chloro-2-methylphenoxy)propanamido]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
ethyl 2-[2-(4-chloro-2-methylphenoxy)propanamido]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 6048-0218 |
| Compound Name: | ethyl 2-[2-(4-chloro-2-methylphenoxy)propanamido]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate |
| Molecular Weight: | 450 |
| Molecular Formula: | C23 H28 Cl N O4 S |
| Smiles: | CCOC(c1c2CCCCCCc2sc1NC(C(C)Oc1ccc(cc1C)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.9778 |
| logD: | 4.545 |
| logSw: | -6.4769 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.005 |
| InChI Key: | SRKSYLMHIMJNBS-HNNXBMFYSA-N |