CP 85339
TL;DR: CP 85339 (CAS 119625-53-5) is a chemical compound with molecular formula C31H49ClN4O6S and molecular weight 640.30615 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
propan-2-yl (2R,3S)-4-cyclohexyl-2-hydroxy-3-[[(2R)-3-methylsulfanyl-1-oxo-1-[[(2S)-3-phenyl-2-[[(2S)-pyrrolidine-2-carbonyl]amino]propanoyl]amino]propan-2-yl]amino]butanoate;hydrochloride
Also Known As: CP 85339, CP-85,339, Isopropyl-4-cyclohexyl-2-hydroxy-3-((propyl-L-phenylalanyl-5-methyl-L-cysteinyl)amino)butanoate hydrochloride, propan-2-yl (2R,3S)-4-cyclohexyl-2-hydroxy-3-[[(2R)-3-methylsulfanyl-1-oxo-1-[[(2S)-3-phenyl-2-[[(2S)-pyrrolidine-2-carbonyl]amino]propanoyl]amino]propan-2-yl]amino]butanoate;hydrochloride, L-Cysteinamide, L-prolyl-L-phenylalanyl-N-(1-(cyclohexylmethyl)-2-hydroxy-3-(1-methylethoxy)-3-oxopropyl)-S-methyl-, monohydrochloride, (R-(R*,S*))-
Technical Specifications
| Molecular Formula | C31H49ClN4O6S |
| Molecular Weight | 640.30615 g/mol |
| XLogP | 2.5032 |
| Topological Polar Surface Area (TPSA) | 171.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 16 |
| Exact Mass | 640.30615 Da |
| Heavy Atoms | 43 |
| Complexity | 877.0 |
| SMILES | CC(C)OC(=O)[C@@H]([C@H](CC1CCCCC1)N[C@@H](CSC)C(=O)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]3CCCN3)O.Cl |
| InChIKey | CPEDLFSOFJMWGO-AUFFENBXSA-N |
Chemical Property Profile of CP 85339
Property Insights of CP 85339
The XLogP value of 2.5032 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CP 85339. The TPSA of 171.0 Ų indicates high polarity, suggesting CP 85339 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CP 85339 has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of CP 85339?
The CAS number of CP 85339 is 119625-53-5.
What is the molecular formula of CP 85339?
The molecular formula of CP 85339 is C31H49ClN4O6S.
What is the molecular weight of CP 85339?
The molecular weight of CP 85339 is 640.30615 g/mol.
Where can I buy CP 85339?
You can request a quote for CP 85339 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for CP 85339?
Yes, CoreyChem provides custom synthesis services for CP 85339 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.