ethyl 5-[(carbamimidoylsulfanyl)methyl]-3-ethyl-2-oxooxolane-3-carboxylate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl 5-[(carbamimidoylsulfanyl)methyl]-3-ethyl-2-oxooxolane-3-carboxylate--hydrogen chloride (1/1)
ethyl 5-[(carbamimidoylsulfanyl)methyl]-3-ethyl-2-oxooxolane-3-carboxylate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 3886-0903 |
| Compound Name: | ethyl 5-[(carbamimidoylsulfanyl)methyl]-3-ethyl-2-oxooxolane-3-carboxylate--hydrogen chloride (1/1) |
| Molecular Weight: | 310.8 |
| Molecular Formula: | C11 H18 N2 O4 S |
| Salt: | HCl |
| Smiles: | CCC1(CC(CSC(N)=N)OC1=O)C(=O)OCC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.9198 |
| logD: | -0.0391 |
| logSw: | -1.6559 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.467 |
| InChI Key: | PCNYWKNVPTYZLX-UHFFFAOYSA-N |