3-{[2-(3,4-diethoxyphenyl)ethyl]amino}-4-hydroxy-1lambda~6~-thiolane-1,1-dione--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-{[2-(3,4-diethoxyphenyl)ethyl]amino}-4-hydroxy-1lambda~6~-thiolane-1,1-dione--hydrogen chloride (1/1)
3-{[2-(3,4-diethoxyphenyl)ethyl]amino}-4-hydroxy-1lambda~6~-thiolane-1,1-dione--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8015-5166 |
| Compound Name: | 3-{[2-(3,4-diethoxyphenyl)ethyl]amino}-4-hydroxy-1lambda~6~-thiolane-1,1-dione--hydrogen chloride (1/1) |
| Molecular Weight: | 379.9 |
| Molecular Formula: | C16 H25 N O5 S |
| Salt: | HCl |
| Smiles: | CCOc1ccc(CCNC2CS(CC2O)(=O)=O)cc1OCC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | -0.5528 |
| logD: | -0.556 |
| logSw: | -1.8633 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.225 |
| InChI Key: | GBAUDIVBNJZRQU-UHFFFAOYSA-N |