4-{[acetyl(2-methylpropyl)amino]methyl}phenyl ethanesulfonate
Chemical Structure Depiction of
4-{[acetyl(2-methylpropyl)amino]methyl}phenyl ethanesulfonate
4-{[acetyl(2-methylpropyl)amino]methyl}phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V025-2853 |
| Compound Name: | 4-{[acetyl(2-methylpropyl)amino]methyl}phenyl ethanesulfonate |
| Molecular Weight: | 313.41 |
| Molecular Formula: | C15 H23 N O4 S |
| Smiles: | CCS(=O)(=O)Oc1ccc(CN(CC(C)C)C(C)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.2317 |
| logD: | 2.2317 |
| logSw: | -2.5241 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.298 |
| InChI Key: | UELUDRCPBXXADP-UHFFFAOYSA-N |