5-{[3,5-dimethoxy-N-(2-methylpropyl)benzamido]methyl}-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
5-{[3,5-dimethoxy-N-(2-methylpropyl)benzamido]methyl}-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
5-{[3,5-dimethoxy-N-(2-methylpropyl)benzamido]methyl}-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V001-3619 |
| Compound Name: | 5-{[3,5-dimethoxy-N-(2-methylpropyl)benzamido]methyl}-2-methoxyphenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 531.6 |
| Molecular Formula: | C27 H30 F N O7 S |
| Smiles: | CC(C)CN(Cc1ccc(c(c1)OS(c1ccc(cc1)F)(=O)=O)OC)C(c1cc(cc(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.826 |
| logD: | 4.826 |
| logSw: | -4.6505 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 75.016 |
| InChI Key: | UVGJQANMGFOXIY-UHFFFAOYSA-N |