4-({N-[(furan-2-yl)methyl]-2-methylpropanamido}methyl)phenyl methanesulfonate
Chemical Structure Depiction of
4-({N-[(furan-2-yl)methyl]-2-methylpropanamido}methyl)phenyl methanesulfonate
4-({N-[(furan-2-yl)methyl]-2-methylpropanamido}methyl)phenyl methanesulfonate
Compound characteristics
| Compound ID: | V012-1522 |
| Compound Name: | 4-({N-[(furan-2-yl)methyl]-2-methylpropanamido}methyl)phenyl methanesulfonate |
| Molecular Weight: | 351.42 |
| Molecular Formula: | C17 H21 N O5 S |
| Smiles: | CC(C)C(N(Cc1ccc(cc1)OS(C)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5234 |
| logD: | 2.5234 |
| logSw: | -2.6636 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.347 |
| InChI Key: | VMAPSVCZCAWWTB-UHFFFAOYSA-N |