Ammonium, (2-chloroethyl)dibenzylmethyl-, methylsulfate
TL;DR: Ammonium, (2-chloroethyl)dibenzylmethyl-, methylsulfate (CAS 64048-30-2) is a chemical compound with molecular formula C18H24ClNO4S and molecular weight 385.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dibenzyl-(2-chloroethyl)-methylazanium;methyl sulfate
Also Known As: (2-Chloroethyl)dibenzylmethylammonium methylsulfate, AMMONIUM, (2-CHLOROETHYL)DIBENZYLMETHYL-, METHYLSULFATE, 2-Chloroethyl-methyl-bis(phenylmethyl)azanium; methyl sulfate, dibenzyl-(2-chloroethyl)-methylazanium,methyl sulfate, dibenzyl-(2-chloroethyl)-methylazanium; methyl sulfate
| Molecular Formula | C18H24ClNO4S |
|---|---|
| Molecular Weight | 385.11 g/mol |
| LogP | 3.17 |
| Topological Polar Surface Area | 74.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 385.11145 |
| Heavy Atoms | 25 |
| Complexity | 312.0 |
Chemical Identifiers
| CAS Number | 64048-30-2 |
|---|---|
| SMILES | C[N+](CCCl)(CC1=CC=CC=C1)CC2=CC=CC=C2.COS(=O)(=O)[O-] |
| InChIKey | WCZWEAPLXPGQBJ-UHFFFAOYSA-M |
Product Overview
Ammonium, (2-chloroethyl)dibenzylmethyl-, methylsulfate (CAS 64048-30-2), with molecular formula C18H24ClNO4S and molecular weight 385.11 g/mol. IUPAC: dibenzyl-(2-chloroethyl)-methylazanium;methyl sulfate.
Chemical Property Profile of Ammonium, (2-chloroethyl)dibenzylmethyl-, methylsulfate
Property Insights of Ammonium, (2-chloroethyl)dibenzylmethyl-, methylsulfate
The XLogP value of 3.17 indicates that Ammonium, (2-chloroethyl)dibenzylmethyl-, methylsulfate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Ammonium, (2-chloroethyl)dibenzylmethyl-, methylsulfate. Following Lipinski's Rule of Five, Ammonium, (2-chloroethyl)dibenzylmethyl-, methylsulfate has 0 hydrogen bond donor(s) and 4 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 Ammonium, (2-chloroethyl)dibenzylmethyl-, methylsulfate?
The CAS number of Ammonium, (2-chloroethyl)dibenzylmethyl-, methylsulfate is 64048-30-2.
What is the molecular formula of Ammonium, (2-chloroethyl)dibenzylmethyl-, methylsulfate?
The molecular formula of Ammonium, (2-chloroethyl)dibenzylmethyl-, methylsulfate is C18H24ClNO4S.
What is the molecular weight of Ammonium, (2-chloroethyl)dibenzylmethyl-, methylsulfate?
The molecular weight of Ammonium, (2-chloroethyl)dibenzylmethyl-, methylsulfate is 385.11 g/mol.
Where can I buy Ammonium, (2-chloroethyl)dibenzylmethyl-, methylsulfate?
You can request a quote for Ammonium, (2-chloroethyl)dibenzylmethyl-, methylsulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, (2-chloroethyl)dibenzylmethyl-, methylsulfate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, (2-chloroethyl)dibenzylmethyl-, methylsulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.