3-({N-[(furan-2-yl)methyl]hexanamido}methyl)phenyl ethanesulfonate
Chemical Structure Depiction of
3-({N-[(furan-2-yl)methyl]hexanamido}methyl)phenyl ethanesulfonate
3-({N-[(furan-2-yl)methyl]hexanamido}methyl)phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V011-3851 |
| Compound Name: | 3-({N-[(furan-2-yl)methyl]hexanamido}methyl)phenyl ethanesulfonate |
| Molecular Weight: | 393.5 |
| Molecular Formula: | C20 H27 N O5 S |
| Smiles: | CCCCCC(N(Cc1cccc(c1)OS(CC)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8288 |
| logD: | 3.8288 |
| logSw: | -3.6791 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.779 |
| InChI Key: | ISISMZKSRJSLPI-UHFFFAOYSA-N |