1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(1-indanyl)-, dihydrochloride
TL;DR: 1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(1-indanyl)-, dihydrochloride (CAS 5085-35-8) is a chemical compound with molecular formula C28H38Cl2N2 and molecular weight 472.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dihydro-1H-inden-1-yl-[[4-[(2,3-dihydro-1H-inden-1-ylazaniumyl)methyl]-1-bicyclo[2.2.2]octanyl]methyl]azanium dichloride
Also Known As: N,N'-Bis(1-indanyl)-1,4-bicyclo(2.2.2)octanebis(methylamine) dihydrochloride, 1-Indanamine, N,N'-(1,4-bicyclo(2.2.2)octylenedimethylene)di-, dihydrochloride, N,N'-(1,4-Bicyclo(2.2.2)octylenedimethylene)di(1-indanamine) dihydrochloride, 1,4-BICYCLO(2.2.2)OCTANEBIS(METHYLAMINE), N,N'-BIS(1-INDANYL)-, DIHYDROCHLORIDE, Bicyclo[2.2.2]octane-1,4-bis(methylamine), N,N'-di-1-indanyl-, dihydrochloride
| Molecular Formula | C28H38Cl2N2 |
|---|---|
| Molecular Weight | 472.24 g/mol |
| LogP | -2.16 |
| Topological Polar Surface Area | 33.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 472.2412 |
| Heavy Atoms | 32 |
| Complexity | 523.0 |
Chemical Identifiers
| CAS Number | 5085-35-8 |
|---|---|
| SMILES | C1CC2=CC=CC=C2C1[NH2+]CC34CCC(CC3)(CC4)C[NH2+]C5CCC6=CC=CC=C56.[Cl-].[Cl-] |
| InChIKey | VTMUHKQETIHHIO-UHFFFAOYSA-N |
Product Overview
1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(1-indanyl)-, dihydrochloride (CAS 5085-35-8), with molecular formula C28H38Cl2N2 and molecular weight 472.24 g/mol. IUPAC: 2,3-dihydro-1H-inden-1-yl-[[4-[(2,3-dihydro-1H-inden-1-ylazaniumyl)methyl]-1-bicyclo[2.2.2]octanyl]methyl]azanium dichloride.
Chemical Property Profile of 1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(1-indanyl)-, dihydrochloride
Property Insights of 1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(1-indanyl)-, dihydrochloride
The XLogP value of -2.16 indicates that 1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(1-indanyl)-, dihydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 33.2 Ų, 1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(1-indanyl)-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(1-indanyl)-, dihydrochloride has 2 hydrogen bond donor(s) and 2 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 1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(1-indanyl)-, dihydrochloride?
The CAS number of 1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(1-indanyl)-, dihydrochloride is 5085-35-8.
What is the molecular formula of 1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(1-indanyl)-, dihydrochloride?
The molecular formula of 1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(1-indanyl)-, dihydrochloride is C28H38Cl2N2.
What is the molecular weight of 1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(1-indanyl)-, dihydrochloride?
The molecular weight of 1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(1-indanyl)-, dihydrochloride is 472.24 g/mol.
Where can I buy 1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(1-indanyl)-, dihydrochloride?
You can request a quote for 1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(1-indanyl)-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(1-indanyl)-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(1-indanyl)-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.