Benzylamine, N,N'-tetramethylenebis(N-(2-chloroethyl)-, dihydrochloride
TL;DR: Benzylamine, N,N'-tetramethylenebis(N-(2-chloroethyl)-, dihydrochloride (CAS 6952-18-7) is a chemical compound with molecular formula C22H32Cl4N2 and molecular weight 464.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl-[4-[benzyl(2-chloroethyl)azaniumyl]butyl]-(2-chloroethyl)azanium dichloride
Also Known As: N,N'-Tetramethylenebis(N-(2-chloroethyl)benzylamine) dihydrochloride, N,N'-Bis(2-chloroethyl)-1,4-dibenzylamino-butane dihydrochloride, BENZYLAMINE, N,N'-TETRAMETHYLENEBIS(N-(2-CHLOROETHYL)-, DIHYDROCHLORIDE, 1,4-Butanediamine, N,N'-bis(2-chloroethyl)-N,N'-bis(phenylmethyl)-, dihydrochloride, 1,4-Butanediamine, N,N'-bis(2-chloroethyl)-N,N'-bis(phenylmethyl)-, dihydrochloride (9CI)
| Molecular Formula | C22H32Cl4N2 |
|---|---|
| Molecular Weight | 464.13 g/mol |
| LogP | -3.58 |
| Topological Polar Surface Area | 8.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 13 |
| Exact Mass | 466.129 |
| Heavy Atoms | 28 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 6952-18-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C[NH+](CCCC[NH+](CCCl)CC2=CC=CC=C2)CCCl.[Cl-].[Cl-] |
| InChIKey | GEIPYSIOBFSXHG-UHFFFAOYSA-N |
Product Overview
Benzylamine, N,N'-tetramethylenebis(N-(2-chloroethyl)-, dihydrochloride (CAS 6952-18-7), with molecular formula C22H32Cl4N2 and molecular weight 464.13 g/mol. IUPAC: benzyl-[4-[benzyl(2-chloroethyl)azaniumyl]butyl]-(2-chloroethyl)azanium dichloride.
Chemical Property Profile of Benzylamine, N,N'-tetramethylenebis(N-(2-chloroethyl)-, dihydrochloride
Property Insights of Benzylamine, N,N'-tetramethylenebis(N-(2-chloroethyl)-, dihydrochloride
The XLogP value of -3.58 indicates that Benzylamine, N,N'-tetramethylenebis(N-(2-chloroethyl)-, dihydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 8.9 Ų, Benzylamine, N,N'-tetramethylenebis(N-(2-chloroethyl)-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzylamine, N,N'-tetramethylenebis(N-(2-chloroethyl)-, 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 Benzylamine, N,N'-tetramethylenebis(N-(2-chloroethyl)-, dihydrochloride?
The CAS number of Benzylamine, N,N'-tetramethylenebis(N-(2-chloroethyl)-, dihydrochloride is 6952-18-7.
What is the molecular formula of Benzylamine, N,N'-tetramethylenebis(N-(2-chloroethyl)-, dihydrochloride?
The molecular formula of Benzylamine, N,N'-tetramethylenebis(N-(2-chloroethyl)-, dihydrochloride is C22H32Cl4N2.
What is the molecular weight of Benzylamine, N,N'-tetramethylenebis(N-(2-chloroethyl)-, dihydrochloride?
The molecular weight of Benzylamine, N,N'-tetramethylenebis(N-(2-chloroethyl)-, dihydrochloride is 464.13 g/mol.
Where can I buy Benzylamine, N,N'-tetramethylenebis(N-(2-chloroethyl)-, dihydrochloride?
You can request a quote for Benzylamine, N,N'-tetramethylenebis(N-(2-chloroethyl)-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzylamine, N,N'-tetramethylenebis(N-(2-chloroethyl)-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzylamine, N,N'-tetramethylenebis(N-(2-chloroethyl)-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.