2-{[(cyclobutanecarbonyl)(propan-2-yl)amino]methyl}phenyl ethanesulfonate
Chemical Structure Depiction of
2-{[(cyclobutanecarbonyl)(propan-2-yl)amino]methyl}phenyl ethanesulfonate
2-{[(cyclobutanecarbonyl)(propan-2-yl)amino]methyl}phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V002-5487 |
| Compound Name: | 2-{[(cyclobutanecarbonyl)(propan-2-yl)amino]methyl}phenyl ethanesulfonate |
| Molecular Weight: | 339.45 |
| Molecular Formula: | C17 H25 N O4 S |
| Smiles: | CCS(=O)(=O)Oc1ccccc1CN(C(C)C)C(C1CCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7272 |
| logD: | 2.7272 |
| logSw: | -3.1689 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.912 |
| InChI Key: | HPGJZMROBJZQNH-UHFFFAOYSA-N |