4-Copab
TL;DR: 4-Copab (CAS 139238-61-2) is a chemical compound with molecular formula C35H47N3O6 and molecular weight 605.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-cyclohexyl-2-hydroxy-3-[2-[[2-(3-oxo-1H-isoindol-2-yl)-3-phenylpropanoyl]amino]pentanoylamino]butanoate
Also Known As: 4-Copab, Cyclohexanebutanoic acid, b-[[2-[[2-(1,3-dihydro-1-oxo-2H-isoindol-2-yl)-1-oxo-3-phenylpropyl]amino]-1-oxopentyl]amino]-a-hydroxy-, 1-methylethyl ester,[aR-[aR*,bS*[S*(S*)]]]- (9CI), propan-2-yl 4-cyclohexyl-2-hydroxy-3-[2-[[2-(3-oxo-1H-isoindol-2-yl)-3-phenylpropanoyl]amino]pentanoylamino]butanoate, 4-cyclohexyl-2-hydroxy-3-((2-((2- butyricacidisopropylester, 4-Cyclohexyl-2-hydroxy-3-((2-((2-(1-oxo-1,3-dihydroisoindol-2-yl)-3-phenylpropionyl)amino)pentanoyl)amino)butyric acid isopropyl ester
| Molecular Formula | C35H47N3O6 |
|---|---|
| Molecular Weight | 605.35 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 15 |
| Exact Mass | 605.3465 |
| Heavy Atoms | 44 |
| Complexity | 960.0 |
Chemical Identifiers
| CAS Number | 139238-61-2 |
|---|---|
| SMILES | CCCC(C(=O)NC(CC1CCCCC1)C(C(=O)OC(C)C)O)NC(=O)C(CC2=CC=CC=C2)N3CC4=CC=CC=C4C3=O |
| InChIKey | PXIHYVZAKDAXEW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Copab (CAS 139238-61-2), with molecular formula C35H47N3O6 and molecular weight 605.35 g/mol. IUPAC: propan-2-yl 4-cyclohexyl-2-hydroxy-3-[2-[[2-(3-oxo-1H-isoindol-2-yl)-3-phenylpropanoyl]amino]pentanoylamino]butanoate.
Chemical Property Profile of 4-Copab
Property Insights of 4-Copab
The XLogP value of 6.2 indicates that 4-Copab is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Copab. Following Lipinski's Rule of Five, 4-Copab has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Copab?
The CAS number of 4-Copab is 139238-61-2.
What is the molecular formula of 4-Copab?
The molecular formula of 4-Copab is C35H47N3O6.
What is the molecular weight of 4-Copab?
The molecular weight of 4-Copab is 605.35 g/mol.
Where can I buy 4-Copab?
You can request a quote for 4-Copab directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Copab?
Yes, KEHONG BIO provides custom synthesis services for 4-Copab and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.