4-{[ethyl-N-(2-methoxyethyl)carbamamido]methyl}phenyl propane-2-sulfonate
Chemical Structure Depiction of
4-{[ethyl-N-(2-methoxyethyl)carbamamido]methyl}phenyl propane-2-sulfonate
4-{[ethyl-N-(2-methoxyethyl)carbamamido]methyl}phenyl propane-2-sulfonate
Compound characteristics
| Compound ID: | V026-7734 |
| Compound Name: | 4-{[ethyl-N-(2-methoxyethyl)carbamamido]methyl}phenyl propane-2-sulfonate |
| Molecular Weight: | 358.46 |
| Molecular Formula: | C16 H26 N2 O5 S |
| Smiles: | CCNC(N(CCOC)Cc1ccc(cc1)OS(C(C)C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.674 |
| logD: | 1.674 |
| logSw: | -2.5308 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.844 |
| InChI Key: | IKODXQIKZULXON-UHFFFAOYSA-N |