1-[[[(1R)-1-[3-[(1S)-1-[[[1-(Carboxymethyl)cyclopropyl]methyl]thio]-2-(7-chloro-2-quinolinyl)ethyl]phenyl]-3-[2-(1-hydroxy-1-methylethyl)phenyl]propyl]thio]methyl]cyclopropaneacetic acid structure
|
Common Name | 1-[[[(1R)-1-[3-[(1S)-1-[[[1-(Carboxymethyl)cyclopropyl]methyl]thio]-2-(7-chloro-2-quinolinyl)ethyl]phenyl]-3-[2-(1-hydroxy-1-methylethyl)phenyl]propyl]thio]methyl]cyclopropaneacetic acid | ||
|---|---|---|---|---|
| CAS Number | 1187586-58-8 | Molecular Weight | 732.39100 | |
| Density | 1.302±0.06 g/cm3 | Boiling Point | 856.9±65.0℃(Predicted) | |
| Molecular Formula | C41H46ClNO5S2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | [R,E]-[[1-[3-[2-(7-chloro-2-quinolinyl)-2-(R)-[(carboxymethyl)cyclopropyl]methyl]thio]ethyl]phenyl]-3-[[[[2-(1-hydroxy-1-methylethyl)phenyl]propyl]thio]methyl]-cyclopropane acetic acid |
|---|---|
| Synonym | More Synonyms |
| Density | 1.302±0.06 g/cm3 |
|---|---|
| Boiling Point | 856.9±65.0℃(Predicted) |
| Molecular Formula | C41H46ClNO5S2 |
| Molecular Weight | 732.39100 |
| Exact Mass | 731.25100 |
| PSA | 158.32000 |
| LogP | 10.04950 |
| InChIKey | SJNODSMYYCYZTO-XDSPJLLDSA-N |
| SMILES | CC(C)(O)c1ccccc1CCC(SCC1(CC(=O)O)CC1)c1cccc(C(Cc2ccc3ccc(Cl)cc3n2)SCC2(CC(=O)O)CC2)c1 |
| Storage condition | 2-8℃ |
| Water Solubility | Insuluble (1.5E-5 g/L) (25 ºC) |
| 2-[(R)-1-[[[1-[3-[2-(7-chloro-2-quinolinyl)-(S)-1-({[1-(carboxymethyl)cyclopropyl]methyl}thio)ethyl]phenyl]-3-[2-(1-hydroxy-1-methylethyl)phenyl]-propyl]thio]methyl]cyclopropane]acetic acid |
| 1-[((1R)-1-(3-(2-(7-chloro-2-quinolinyl)-(2R)-2-((1-carboxymethylcyclopropyl)methylthio)ethyl)pheny)-3-(2-(1-hydroxy-1-methylethyl)phenyl)propylthio)methyl]cyclopropaneacetic acid |
| 1-[[[(1R)-1-[3-[(1S)-1-[[[1-(Carboxymethyl)cyclopropyl]methyl]thio]-2-(7-chloro-2-quinolinyl)ethyl]phenyl]-3-[2-(1-hydroxy-1-methylethyl)phenyl]propyl]thio]methyl]cyclopropaneacetic acid |
| Montelukast Impurity 5 |