4-{[(cyclopropanecarbonyl)(3-methylbutyl)amino]methyl}phenyl methanesulfonate
Chemical Structure Depiction of
4-{[(cyclopropanecarbonyl)(3-methylbutyl)amino]methyl}phenyl methanesulfonate
4-{[(cyclopropanecarbonyl)(3-methylbutyl)amino]methyl}phenyl methanesulfonate
Compound characteristics
| Compound ID: | V005-7373 |
| Compound Name: | 4-{[(cyclopropanecarbonyl)(3-methylbutyl)amino]methyl}phenyl methanesulfonate |
| Molecular Weight: | 339.45 |
| Molecular Formula: | C17 H25 N O4 S |
| Smiles: | CC(C)CCN(Cc1ccc(cc1)OS(C)(=O)=O)C(C1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0685 |
| logD: | 3.0685 |
| logSw: | -3.3148 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.1 |
| InChI Key: | XBPBTPFQSMGEKP-UHFFFAOYSA-N |