diethyl 2,2'-[(1,5-dioxopentane-1,5-diyl)bis(azanediyl)]di(4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate)
Chemical Structure Depiction of
diethyl 2,2'-[(1,5-dioxopentane-1,5-diyl)bis(azanediyl)]di(4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate)
diethyl 2,2'-[(1,5-dioxopentane-1,5-diyl)bis(azanediyl)]di(4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate)
Compound characteristics
| Compound ID: | Y508-5543 |
| Compound Name: | diethyl 2,2'-[(1,5-dioxopentane-1,5-diyl)bis(azanediyl)]di(4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate) |
| Molecular Weight: | 602.81 |
| Molecular Formula: | C31 H42 N2 O6 S2 |
| Smiles: | CCOC(c1c2CCCCCCc2sc1NC(CCCC(Nc1c(C(=O)OCC)c2CCCCCCc2s1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.583 |
| logD: | 4.2593 |
| logSw: | -5.6551 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.865 |
| InChI Key: | HPJNJJJUDGEFNO-UHFFFAOYSA-N |