diethyl 2,2'-[1,3-phenylenebis(carbonylazanediyl)]di(4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate)
Chemical Structure Depiction of
diethyl 2,2'-[1,3-phenylenebis(carbonylazanediyl)]di(4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate)
diethyl 2,2'-[1,3-phenylenebis(carbonylazanediyl)]di(4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate)
Compound characteristics
| Compound ID: | Y503-0143 |
| Compound Name: | diethyl 2,2'-[1,3-phenylenebis(carbonylazanediyl)]di(4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate) |
| Molecular Weight: | 636.83 |
| Molecular Formula: | C34 H40 N2 O6 S2 |
| Smiles: | CCOC(c1c2CCCCCCc2sc1NC(c1cccc(c1)C(Nc1c(C(=O)OCC)c2CCCCCCc2s1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 8.134 |
| logD: | 3.5787 |
| logSw: | -5.7001 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.02 |
| InChI Key: | OGMSZYFQSNEDJU-UHFFFAOYSA-N |