4-{[3,4,5-trimethoxy-N-(propan-2-yl)benzamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
4-{[3,4,5-trimethoxy-N-(propan-2-yl)benzamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
4-{[3,4,5-trimethoxy-N-(propan-2-yl)benzamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V007-0752 |
| Compound Name: | 4-{[3,4,5-trimethoxy-N-(propan-2-yl)benzamido]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 517.57 |
| Molecular Formula: | C26 H28 F N O7 S |
| Smiles: | CC(C)N(Cc1ccc(cc1)OS(c1ccc(cc1)F)(=O)=O)C(c1cc(c(c(c1)OC)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3124 |
| logD: | 4.3124 |
| logSw: | -4.3329 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.933 |
| InChI Key: | WJKLJTLHIGYDFD-UHFFFAOYSA-N |