3-{[(butan-2-yl)(cyclobutanecarbonyl)amino]methyl}phenyl propane-2-sulfonate
Chemical Structure Depiction of
3-{[(butan-2-yl)(cyclobutanecarbonyl)amino]methyl}phenyl propane-2-sulfonate
3-{[(butan-2-yl)(cyclobutanecarbonyl)amino]methyl}phenyl propane-2-sulfonate
Compound characteristics
| Compound ID: | V026-9917 |
| Compound Name: | 3-{[(butan-2-yl)(cyclobutanecarbonyl)amino]methyl}phenyl propane-2-sulfonate |
| Molecular Weight: | 367.51 |
| Molecular Formula: | C19 H29 N O4 S |
| Smiles: | CCC(C)N(Cc1cccc(c1)OS(C(C)C)(=O)=O)C(C1CCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3296 |
| logD: | 3.3296 |
| logSw: | -3.5202 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.334 |
| InChI Key: | UNDSJFQMLIDHHP-HNNXBMFYSA-N |