2-methoxy-5-({[(oxolan-2-yl)methyl](thiophene-2-carbonyl)amino}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate
Chemical Structure Depiction of
2-methoxy-5-({[(oxolan-2-yl)methyl](thiophene-2-carbonyl)amino}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate
2-methoxy-5-({[(oxolan-2-yl)methyl](thiophene-2-carbonyl)amino}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V025-5064 |
| Compound Name: | 2-methoxy-5-({[(oxolan-2-yl)methyl](thiophene-2-carbonyl)amino}methyl)phenyl 3,4-dichlorobenzene-1-sulfonate |
| Molecular Weight: | 556.48 |
| Molecular Formula: | C24 H23 Cl2 N O6 S2 |
| Smiles: | COc1ccc(CN(CC2CCCO2)C(c2cccs2)=O)cc1OS(c1ccc(c(c1)[Cl])[Cl])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6902 |
| logD: | 4.6902 |
| logSw: | -4.8743 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.329 |
| InChI Key: | SUPYGMJBJICLHJ-QGZVFWFLSA-N |