CP 85339
TL;DR: CP 85339 (CAS 119625-53-5) is a chemical compound with molecular formula C31H49ClN4O6S and molecular weight 640.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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*))-
| Molecular Formula | C31H49ClN4O6S |
|---|---|
| Molecular Weight | 640.31 g/mol |
| LogP | 2.5032 |
| Topological Polar Surface Area | 145.86 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 15 |
| Exact Mass | 640.30615 |
| Heavy Atoms | 43 |
| Complexity | 1020.79004 |
Chemical Identifiers
| CAS Number | 119625-53-5 |
|---|---|
| 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 |
Product Overview
CP 85339 (CAS 119625-53-5), with molecular formula C31H49ClN4O6S and molecular weight 640.31 g/mol. IUPAC: 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.
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 145.86 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 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
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 640.31 g/mol.
Where can I buy CP 85339?
You can request a quote for CP 85339 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CP 85339?
Yes, KEHONG BIO provides custom synthesis services for CP 85339 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.