methyl N-[{5-bromo-2-[(4-methylbenzene-1-sulfonyl)amino]phenyl}(phenyl)methyl]-N-(4-methylbenzene-1-sulfonyl)glycinate
Chemical Structure Depiction of
methyl N-[{5-bromo-2-[(4-methylbenzene-1-sulfonyl)amino]phenyl}(phenyl)methyl]-N-(4-methylbenzene-1-sulfonyl)glycinate
methyl N-[{5-bromo-2-[(4-methylbenzene-1-sulfonyl)amino]phenyl}(phenyl)methyl]-N-(4-methylbenzene-1-sulfonyl)glycinate
Compound characteristics
| Compound ID: | 0831-1152 |
| Compound Name: | methyl N-[{5-bromo-2-[(4-methylbenzene-1-sulfonyl)amino]phenyl}(phenyl)methyl]-N-(4-methylbenzene-1-sulfonyl)glycinate |
| Molecular Weight: | 657.6 |
| Molecular Formula: | C30 H29 Br N2 O6 S2 |
| Smiles: | Cc1ccc(cc1)S(Nc1ccc(cc1C(c1ccccc1)N(CC(=O)OC)S(c1ccc(C)cc1)(=O)=O)[Br])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.9075 |
| logD: | 6.6353 |
| logSw: | -5.5671 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.896 |
| InChI Key: | SWNWVVBNCSGNBX-PMERELPUSA-N |