4-{[(furan-2-carbonyl)(propan-2-yl)amino]methyl}phenyl propane-2-sulfonate
Chemical Structure Depiction of
4-{[(furan-2-carbonyl)(propan-2-yl)amino]methyl}phenyl propane-2-sulfonate
4-{[(furan-2-carbonyl)(propan-2-yl)amino]methyl}phenyl propane-2-sulfonate
Compound characteristics
| Compound ID: | V026-2440 |
| Compound Name: | 4-{[(furan-2-carbonyl)(propan-2-yl)amino]methyl}phenyl propane-2-sulfonate |
| Molecular Weight: | 365.45 |
| Molecular Formula: | C18 H23 N O5 S |
| Smiles: | CC(C)N(Cc1ccc(cc1)OS(C(C)C)(=O)=O)C(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9051 |
| logD: | 2.9051 |
| logSw: | -3.2863 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.805 |
| InChI Key: | NJPXZWWIWUFJIK-UHFFFAOYSA-N |