5-({2-chloro-N-[(oxolan-2-yl)methyl]benzamido}methyl)-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
Chemical Structure Depiction of
5-({2-chloro-N-[(oxolan-2-yl)methyl]benzamido}methyl)-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
5-({2-chloro-N-[(oxolan-2-yl)methyl]benzamido}methyl)-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V025-5074 |
| Compound Name: | 5-({2-chloro-N-[(oxolan-2-yl)methyl]benzamido}methyl)-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate |
| Molecular Weight: | 584.9 |
| Molecular Formula: | C26 H24 Cl3 N O6 S |
| Smiles: | COc1ccc(CN(CC2CCCO2)C(c2ccccc2[Cl])=O)cc1OS(c1ccc(c(c1)[Cl])[Cl])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9678 |
| logD: | 4.9678 |
| logSw: | -5.0438 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.311 |
| InChI Key: | CSKRHTWOSVZVCA-GOSISDBHSA-N |