methyl 2-[(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-[(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
methyl 2-[(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y508-8423 |
| Compound Name: | methyl 2-[(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate |
| Molecular Weight: | 401.57 |
| Molecular Formula: | C23 H31 N O3 S |
| Smiles: | COC(c1c2CCCCCCc2sc1NC(C12CC3CC(CC(C3)C2)C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4354 |
| logD: | 3.2177 |
| logSw: | -5.6825 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.583 |
| InChI Key: | LCOMYLZFCGAZMK-UHFFFAOYSA-N |