3-({N-[(furan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl propane-2-sulfonate
Chemical Structure Depiction of
3-({N-[(furan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl propane-2-sulfonate
3-({N-[(furan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl propane-2-sulfonate
Compound characteristics
| Compound ID: | V026-7652 |
| Compound Name: | 3-({N-[(furan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl propane-2-sulfonate |
| Molecular Weight: | 394.49 |
| Molecular Formula: | C19 H26 N2 O5 S |
| Smiles: | CC(C)NC(N(Cc1cccc(c1)OS(C(C)C)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3132 |
| logD: | 3.3132 |
| logSw: | -3.8329 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.349 |
| InChI Key: | RHXAMFQQKAJSAA-UHFFFAOYSA-N |