4-{[(butan-2-yl)(cyclohexanecarbonyl)amino]methyl}phenyl ethanesulfonate
Chemical Structure Depiction of
4-{[(butan-2-yl)(cyclohexanecarbonyl)amino]methyl}phenyl ethanesulfonate
4-{[(butan-2-yl)(cyclohexanecarbonyl)amino]methyl}phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V016-9721 |
| Compound Name: | 4-{[(butan-2-yl)(cyclohexanecarbonyl)amino]methyl}phenyl ethanesulfonate |
| Molecular Weight: | 381.53 |
| Molecular Formula: | C20 H31 N O4 S |
| Smiles: | CCC(C)N(Cc1ccc(cc1)OS(CC)(=O)=O)C(C1CCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1298 |
| logD: | 4.1298 |
| logSw: | -3.9759 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.078 |
| InChI Key: | WYGFPHTXUFCLHQ-INIZCTEOSA-N |