ethyl 5-[(carbamimidoylsulfanyl)methyl]-3-(3-methylbutyl)-2-oxooxolane-3-carboxylate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl 5-[(carbamimidoylsulfanyl)methyl]-3-(3-methylbutyl)-2-oxooxolane-3-carboxylate--hydrogen chloride (1/1)
ethyl 5-[(carbamimidoylsulfanyl)methyl]-3-(3-methylbutyl)-2-oxooxolane-3-carboxylate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 3886-0957 |
| Compound Name: | ethyl 5-[(carbamimidoylsulfanyl)methyl]-3-(3-methylbutyl)-2-oxooxolane-3-carboxylate--hydrogen chloride (1/1) |
| Molecular Weight: | 352.88 |
| Molecular Formula: | C14 H24 N2 O4 S |
| Salt: | HCl |
| Smiles: | CCOC(C1(CCC(C)C)CC(CSC(N)=N)OC1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.1982 |
| logD: | 1.2393 |
| logSw: | -2.327 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.467 |
| InChI Key: | QFKWHOWLLJPQED-UHFFFAOYSA-N |