5-{[2-chloro-N-(propan-2-yl)benzamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
5-{[2-chloro-N-(propan-2-yl)benzamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
5-{[2-chloro-N-(propan-2-yl)benzamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V028-0297 |
| Compound Name: | 5-{[2-chloro-N-(propan-2-yl)benzamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 504 |
| Molecular Formula: | C25 H26 Cl N O6 S |
| Smiles: | CC(C)N(Cc1ccc(c(c1)OS(c1ccc(cc1)OC)(=O)=O)OC)C(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.615 |
| logD: | 4.615 |
| logSw: | -4.7752 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.215 |
| InChI Key: | XQXTWQIEWAVDRZ-UHFFFAOYSA-N |