4-{[acetyl(2-methylpropyl)amino]methyl}phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
4-{[acetyl(2-methylpropyl)amino]methyl}phenyl 4-methoxybenzene-1-sulfonate
4-{[acetyl(2-methylpropyl)amino]methyl}phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V009-3200 |
| Compound Name: | 4-{[acetyl(2-methylpropyl)amino]methyl}phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 391.48 |
| Molecular Formula: | C20 H25 N O5 S |
| Smiles: | CC(C)CN(Cc1ccc(cc1)OS(c1ccc(cc1)OC)(=O)=O)C(C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5556 |
| logD: | 3.5556 |
| logSw: | -3.67 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.494 |
| InChI Key: | CUTLUTZOHPGBAK-UHFFFAOYSA-N |