3-{[(furan-2-carbonyl)(2-methylpropyl)amino]methyl}phenyl methanesulfonate
Chemical Structure Depiction of
3-{[(furan-2-carbonyl)(2-methylpropyl)amino]methyl}phenyl methanesulfonate
3-{[(furan-2-carbonyl)(2-methylpropyl)amino]methyl}phenyl methanesulfonate
Compound characteristics
| Compound ID: | V029-9790 |
| Compound Name: | 3-{[(furan-2-carbonyl)(2-methylpropyl)amino]methyl}phenyl methanesulfonate |
| Molecular Weight: | 351.42 |
| Molecular Formula: | C17 H21 N O5 S |
| Smiles: | CC(C)CN(Cc1cccc(c1)OS(C)(=O)=O)C(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6816 |
| logD: | 2.6816 |
| logSw: | -3.0297 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.177 |
| InChI Key: | AVNUUHYJZBDOKF-UHFFFAOYSA-N |