5-{[3-(ethoxycarbonyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl]amino}-5-oxopentanoic acid
Chemical Structure Depiction of
5-{[3-(ethoxycarbonyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl]amino}-5-oxopentanoic acid
5-{[3-(ethoxycarbonyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl]amino}-5-oxopentanoic acid
Compound characteristics
| Compound ID: | 6049-1175 |
| Compound Name: | 5-{[3-(ethoxycarbonyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl]amino}-5-oxopentanoic acid |
| Molecular Weight: | 367.46 |
| Molecular Formula: | C18 H25 N O5 S |
| Smiles: | CCOC(c1c2CCCCCCc2sc1NC(CCCC(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9138 |
| logD: | 0.3166 |
| logSw: | -3.2607 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.571 |
| InChI Key: | ICRUDRZPPANODG-UHFFFAOYSA-N |