ethyl 5-[(carbamimidoylsulfanyl)methyl]-2-oxo-3-pentyloxolane-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[(carbamimidoylsulfanyl)methyl]-2-oxo-3-pentyloxolane-3-carboxylate
ethyl 5-[(carbamimidoylsulfanyl)methyl]-2-oxo-3-pentyloxolane-3-carboxylate
Compound characteristics
Compound ID: | 3886-0958 |
Compound Name: | ethyl 5-[(carbamimidoylsulfanyl)methyl]-2-oxo-3-pentyloxolane-3-carboxylate |
Molecular Weight: | 352.88 |
Molecular Formula: | C14 H24 N2 O4 S |
Salt: | HCl |
Smiles: | CCCCCC1(CC(CSC(N)=N)OC1=O)C(=O)OCC |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 2.4654 |
logD: | 1.5065 |
logSw: | -2.6387 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 82.467 |
InChI Key: | ZZDUENIWLHLXCW-UHFFFAOYSA-N |