4-{[([1,1'-biphenyl]-4-carbonyl)(butan-2-yl)amino]methyl}phenyl methanesulfonate
Chemical Structure Depiction of
4-{[([1,1'-biphenyl]-4-carbonyl)(butan-2-yl)amino]methyl}phenyl methanesulfonate
4-{[([1,1'-biphenyl]-4-carbonyl)(butan-2-yl)amino]methyl}phenyl methanesulfonate
Compound characteristics
| Compound ID: | V028-0158 |
| Compound Name: | 4-{[([1,1'-biphenyl]-4-carbonyl)(butan-2-yl)amino]methyl}phenyl methanesulfonate |
| Molecular Weight: | 437.56 |
| Molecular Formula: | C25 H27 N O4 S |
| Smiles: | CCC(C)N(Cc1ccc(cc1)OS(C)(=O)=O)C(c1ccc(cc1)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1531 |
| logD: | 5.1531 |
| logSw: | -5.2068 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.655 |
| InChI Key: | JPRYMSGWGDIIGH-IBGZPJMESA-N |