beta-Naltrexamine
TL;DR: beta-Naltrexamine (CAS 67025-97-2) is a chemical compound with molecular formula C20H26N2O3 and molecular weight 342.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R,4aS,7R,7aR,12bS)-7-amino-3-(cyclopropylmethyl)-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-4a,9-diol
Also Known As: beta-Naltrexamine, b-Naltrexamine, 6beta-Naltrexamine, SID:134224380, beta-Naltrexamine dihydrochloride, >=98% (HPLC)
| Molecular Formula | C20H26N2O3 |
|---|---|
| Molecular Weight | 342.19 g/mol |
| LogP | 1.2836 |
| Topological Polar Surface Area | 78.95 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 342.19434 |
| Heavy Atoms | 25 |
| Complexity | 763.55334 |
Chemical Identifiers
| CAS Number | 67025-97-2 |
|---|---|
| SMILES | C1C[C@]2([C@H]3CC4=C5[C@@]2(CCN3CC6CC6)[C@H]([C@@H]1N)OC5=C(C=C4)O)O |
Product Overview
beta-Naltrexamine (CAS 67025-97-2), with molecular formula C20H26N2O3 and molecular weight 342.19 g/mol. IUPAC: (4R,4aS,7R,7aR,12bS)-7-amino-3-(cyclopropylmethyl)-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-4a,9-diol.
Chemical Property Profile of beta-Naltrexamine
Property Insights of beta-Naltrexamine
The XLogP value of 1.2836 suggests moderate lipophilicity, balancing water solubility and membrane permeability for beta-Naltrexamine. The TPSA of 78.95 Ų falls within the moderate polarity range, balancing permeability and solubility for beta-Naltrexamine. Following Lipinski's Rule of Five, beta-Naltrexamine has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of beta-Naltrexamine?
The CAS number of beta-Naltrexamine is 67025-97-2.
What is the molecular formula of beta-Naltrexamine?
The molecular formula of beta-Naltrexamine is C20H26N2O3.
What is the molecular weight of beta-Naltrexamine?
The molecular weight of beta-Naltrexamine is 342.19 g/mol.
Where can I buy beta-Naltrexamine?
You can request a quote for beta-Naltrexamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-Naltrexamine?
Yes, KEHONG BIO provides custom synthesis services for beta-Naltrexamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.