4-{[3,5-dimethoxy-N-(propan-2-yl)benzamido]methyl}phenyl methanesulfonate
Chemical Structure Depiction of
4-{[3,5-dimethoxy-N-(propan-2-yl)benzamido]methyl}phenyl methanesulfonate
4-{[3,5-dimethoxy-N-(propan-2-yl)benzamido]methyl}phenyl methanesulfonate
Compound characteristics
| Compound ID: | V014-1244 |
| Compound Name: | 4-{[3,5-dimethoxy-N-(propan-2-yl)benzamido]methyl}phenyl methanesulfonate |
| Molecular Weight: | 407.48 |
| Molecular Formula: | C20 H25 N O6 S |
| Smiles: | CC(C)N(Cc1ccc(cc1)OS(C)(=O)=O)C(c1cc(cc(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1304 |
| logD: | 3.1304 |
| logSw: | -3.4318 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.43 |
| InChI Key: | ATMQEWUTHWHVSA-UHFFFAOYSA-N |