3-{[(furan-2-carbonyl)(propan-2-yl)amino]methyl}phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
3-{[(furan-2-carbonyl)(propan-2-yl)amino]methyl}phenyl 4-methoxybenzene-1-sulfonate
3-{[(furan-2-carbonyl)(propan-2-yl)amino]methyl}phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-7837 |
| Compound Name: | 3-{[(furan-2-carbonyl)(propan-2-yl)amino]methyl}phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 429.49 |
| Molecular Formula: | C22 H23 N O6 S |
| Smiles: | CC(C)N(Cc1cccc(c1)OS(c1ccc(cc1)OC)(=O)=O)C(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.804 |
| logD: | 3.804 |
| logSw: | -4.0586 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.077 |
| InChI Key: | YZMFCBKJFOHTPL-UHFFFAOYSA-N |