3,3'-Diphenyl-2,2'-(azodi-(m-phenylene))diacrylic acid bis(3-tropanyl) ester 2HCl dihydrate
TL;DR: 3,3'-Diphenyl-2,2'-(azodi-(m-phenylene))diacrylic acid bis(3-tropanyl) ester 2HCl dihydrate (CAS 31915-45-4) is a chemical compound with molecular formula C46H50Cl2N4O4 and molecular weight 792.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (Z)-2-[3-[[3-[(Z)-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-3-oxo-1-phenylprop-1-en-2-yl]phenyl]diazenyl]phenyl]-3-phenylprop-2-enoate;dihydrochloride
Also Known As: 3,3'-Diphenyl-2,2'-(azodi-(m-phenylene))diacrylic acid bis(3-tropanyl) ester 2HCl dihydrate, 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, 2,2'-(azodi-m-phenylene)bis(3- phenylacrylate) (2:1) (ester), dihydrochloride, dihydrate, (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (Z)-2-[3-[[3-[(Z)-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-3-oxo-1-phenylprop-1-en-2-yl]phenyl]diazenyl]phenyl]-3-phenylprop-2-enoate dihydrochloride
| Molecular Formula | C46H50Cl2N4O4 |
|---|---|
| Molecular Weight | 792.32 g/mol |
| LogP | 10.3636 |
| Topological Polar Surface Area | 83.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 792.3209 |
| Heavy Atoms | 56 |
| Complexity | 1898.6562 |
Chemical Identifiers
| CAS Number | 31915-45-4 |
|---|---|
| SMILES | CN1C2CC(CC1CC2)OC(=O)/C(=C\C3=CC=CC=C3)/C4=CC(=CC=C4)N=NC5=CC=CC(=C5)/C(=C/C6=CC=CC=C6)/C(=O)OC7CC8N(C(C7)CC8)C.Cl.Cl |
Product Overview
3,3'-Diphenyl-2,2'-(azodi-(m-phenylene))diacrylic acid bis(3-tropanyl) ester 2HCl dihydrate (CAS 31915-45-4), with molecular formula C46H50Cl2N4O4 and molecular weight 792.32 g/mol. IUPAC: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (Z)-2-[3-[[3-[(Z)-3-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-3-oxo-1-phenylprop-1-en-2-yl]phenyl]diazenyl]phenyl]-3-phenylprop-2-enoate;dihydrochloride.
Chemical Property Profile of 3,3'-Diphenyl-2,2'-(azodi-(m-phenylene))diacrylic acid bis(3-tropanyl) ester 2HCl dihydrate
Property Insights of 3,3'-Diphenyl-2,2'-(azodi-(m-phenylene))diacrylic acid bis(3-tropanyl) ester 2HCl dihydrate
The XLogP value of 10.3636 indicates that 3,3'-Diphenyl-2,2'-(azodi-(m-phenylene))diacrylic acid bis(3-tropanyl) ester 2HCl dihydrate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3'-Diphenyl-2,2'-(azodi-(m-phenylene))diacrylic acid bis(3-tropanyl) ester 2HCl dihydrate. Following Lipinski's Rule of Five, 3,3'-Diphenyl-2,2'-(azodi-(m-phenylene))diacrylic acid bis(3-tropanyl) ester 2HCl dihydrate has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,3'-Diphenyl-2,2'-(azodi-(m-phenylene))diacrylic acid bis(3-tropanyl) ester 2HCl dihydrate?
The CAS number of 3,3'-Diphenyl-2,2'-(azodi-(m-phenylene))diacrylic acid bis(3-tropanyl) ester 2HCl dihydrate is 31915-45-4.
What is the molecular formula of 3,3'-Diphenyl-2,2'-(azodi-(m-phenylene))diacrylic acid bis(3-tropanyl) ester 2HCl dihydrate?
The molecular formula of 3,3'-Diphenyl-2,2'-(azodi-(m-phenylene))diacrylic acid bis(3-tropanyl) ester 2HCl dihydrate is C46H50Cl2N4O4.
What is the molecular weight of 3,3'-Diphenyl-2,2'-(azodi-(m-phenylene))diacrylic acid bis(3-tropanyl) ester 2HCl dihydrate?
The molecular weight of 3,3'-Diphenyl-2,2'-(azodi-(m-phenylene))diacrylic acid bis(3-tropanyl) ester 2HCl dihydrate is 792.32 g/mol.
Where can I buy 3,3'-Diphenyl-2,2'-(azodi-(m-phenylene))diacrylic acid bis(3-tropanyl) ester 2HCl dihydrate?
You can request a quote for 3,3'-Diphenyl-2,2'-(azodi-(m-phenylene))diacrylic acid bis(3-tropanyl) ester 2HCl dihydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-Diphenyl-2,2'-(azodi-(m-phenylene))diacrylic acid bis(3-tropanyl) ester 2HCl dihydrate?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-Diphenyl-2,2'-(azodi-(m-phenylene))diacrylic acid bis(3-tropanyl) ester 2HCl dihydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.