3-{[2-chloro-N-(2-methylpropyl)benzamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
3-{[2-chloro-N-(2-methylpropyl)benzamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
3-{[2-chloro-N-(2-methylpropyl)benzamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-7823 |
| Compound Name: | 3-{[2-chloro-N-(2-methylpropyl)benzamido]methyl}phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 488 |
| Molecular Formula: | C25 H26 Cl N O5 S |
| Smiles: | CC(C)CN(Cc1cccc(c1)OS(c1ccc(cc1)OC)(=O)=O)C(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.2987 |
| logD: | 5.2987 |
| logSw: | -5.7477 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.755 |
| InChI Key: | JOVMADDHYVXULI-UHFFFAOYSA-N |