2-(3,4,5-triethoxybenzamido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Chemical Structure Depiction of
2-(3,4,5-triethoxybenzamido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
2-(3,4,5-triethoxybenzamido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Compound characteristics
| Compound ID: | Y503-0176 |
| Compound Name: | 2-(3,4,5-triethoxybenzamido)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide |
| Molecular Weight: | 460.59 |
| Molecular Formula: | C24 H32 N2 O5 S |
| Smiles: | CCOc1cc(cc(c1OCC)OCC)C(Nc1c(C(N)=O)c2CCCCCCc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7257 |
| logD: | 3.402 |
| logSw: | -4.2357 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.152 |
| InChI Key: | KCPKKCJFZOQDBQ-UHFFFAOYSA-N |