R-4066 oxalate
TL;DR: R-4066 oxalate (CAS 10169-24-1) is a chemical compound with molecular formula C34H39NO5 and molecular weight 541.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-diphenyl-6-spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-ylhexan-3-one;oxalic acid
Also Known As: R-4066 oxalate, 1-(3,3'-Diphenyl-4-oxohexyl)piperidine-4-spiro-1'(1',2',3',4'-tetrahydronaphthalene) oxalate, 3-Hexanone, 4,4-diphenyl-6-(2,3-dihydrospiro(naphthalene-1(4H),4'-piperid)-1'-yl)-, oxalate, 4,4-diphenyl-6-spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-ylhexan-3-one;oxalic acid, 6-(3,4-dihydro-1/'H,2H-spiro[naphthalene-1,4/'-piperidin]-1/'-yl)-4,4-diphenylhexan-3-one
| Molecular Formula | C34H39NO5 |
|---|---|
| Molecular Weight | 541.28 g/mol |
| LogP | 5.8676 |
| Topological Polar Surface Area | 94.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 541.28284 |
| Heavy Atoms | 40 |
| Complexity | 703.0 |
Chemical Identifiers
| CAS Number | 10169-24-1 |
|---|---|
| SMILES | CCC(=O)C(CCN1CCC2(CCCC3=CC=CC=C32)CC1)(C4=CC=CC=C4)C5=CC=CC=C5.C(=O)(C(=O)O)O |
| InChIKey | DRZCBAHULALFNW-UHFFFAOYSA-N |
Product Overview
R-4066 oxalate (CAS 10169-24-1), with molecular formula C34H39NO5 and molecular weight 541.28 g/mol. IUPAC: 4,4-diphenyl-6-spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]-1'-ylhexan-3-one;oxalic acid.
Chemical Property Profile of R-4066 oxalate
Property Insights of R-4066 oxalate
The XLogP value of 5.8676 indicates that R-4066 oxalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.9 Ų falls within the moderate polarity range, balancing permeability and solubility for R-4066 oxalate. Following Lipinski's Rule of Five, R-4066 oxalate has 2 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 R-4066 oxalate?
The CAS number of R-4066 oxalate is 10169-24-1.
What is the molecular formula of R-4066 oxalate?
The molecular formula of R-4066 oxalate is C34H39NO5.
What is the molecular weight of R-4066 oxalate?
The molecular weight of R-4066 oxalate is 541.28 g/mol.
Where can I buy R-4066 oxalate?
You can request a quote for R-4066 oxalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for R-4066 oxalate?
Yes, KEHONG BIO provides custom synthesis services for R-4066 oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.