4-{[N-(butan-2-yl)butanamido]methyl}phenyl ethanesulfonate
Chemical Structure Depiction of
4-{[N-(butan-2-yl)butanamido]methyl}phenyl ethanesulfonate
4-{[N-(butan-2-yl)butanamido]methyl}phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V006-8174 |
| Compound Name: | 4-{[N-(butan-2-yl)butanamido]methyl}phenyl ethanesulfonate |
| Molecular Weight: | 341.47 |
| Molecular Formula: | C17 H27 N O4 S |
| Smiles: | CCCC(N(Cc1ccc(cc1)OS(CC)(=O)=O)C(C)CC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3701 |
| logD: | 3.3701 |
| logSw: | -3.5386 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.631 |
| InChI Key: | RMWVXQWBFMDISO-AWEZNQCLSA-N |