2-[1-(acetyloxy)ethyl]-2-[(1-methyl-4-propylpyrrolidine-2-carbonyl)amino]-6-(methylsulfanyl)oxane-3,4,5-triyl triacetate
Chemical Structure Depiction of
2-[1-(acetyloxy)ethyl]-2-[(1-methyl-4-propylpyrrolidine-2-carbonyl)amino]-6-(methylsulfanyl)oxane-3,4,5-triyl triacetate
2-[1-(acetyloxy)ethyl]-2-[(1-methyl-4-propylpyrrolidine-2-carbonyl)amino]-6-(methylsulfanyl)oxane-3,4,5-triyl triacetate
Compound characteristics
| Compound ID: | 3455-1139 |
| Compound Name: | 2-[1-(acetyloxy)ethyl]-2-[(1-methyl-4-propylpyrrolidine-2-carbonyl)amino]-6-(methylsulfanyl)oxane-3,4,5-triyl triacetate |
| Molecular Weight: | 560.66 |
| Molecular Formula: | C25 H40 N2 O10 S |
| Smiles: | CCCC1CC(C(NC2(C(C)OC(C)=O)C(C(C(C(O2)SC)OC(C)=O)OC(C)=O)OC(C)=O)=O)N(C)C1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.893 |
| logD: | 0.1121 |
| logSw: | -2.4676 |
| Hydrogen bond acceptors count: | 17 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 117.415 |
| InChI Key: | DARVXQDVSMWTSV-UHFFFAOYSA-N |