5-{[N-(butan-2-yl)(2-methoxyphenyl)carbamamido]methyl}-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
Chemical Structure Depiction of
5-{[N-(butan-2-yl)(2-methoxyphenyl)carbamamido]methyl}-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
5-{[N-(butan-2-yl)(2-methoxyphenyl)carbamamido]methyl}-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-4348 |
| Compound Name: | 5-{[N-(butan-2-yl)(2-methoxyphenyl)carbamamido]methyl}-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate |
| Molecular Weight: | 567.49 |
| Molecular Formula: | C26 H28 Cl2 N2 O6 S |
| Smiles: | CCC(C)N(Cc1ccc(c(c1)OS(c1ccc(c(c1)[Cl])[Cl])(=O)=O)OC)C(Nc1ccccc1OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2199 |
| logD: | 6.2199 |
| logSw: | -6.082 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.01 |
| InChI Key: | KSDNCPSYLPMJEG-KRWDZBQOSA-N |