C19H24ClNS.BrH
TL;DR: C19H24ClNS.BrH (CAS 899-55-8) is a chemical compound with molecular formula C19H25BrClNS and molecular weight 413.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(5-chloro-2-methylsulfanylphenyl)-N,N-dimethyl-4-phenylbutan-1-amine;hydrobromide
Also Known As: 4-(5-Chloro-2-(methylthio)phenyl)-N,N-dimethyl-4-phenylbutylamine hydrobromide, Butylamine, 4-(5-chloro-2-(methylthio)phenyl)-N,N-dimethyl-4-phenyl-, hydrobromide, 4-[5-chloro-2-(methylsulfanyl)phenyl]-n,n-dimethyl-4-phenylbutan-1-amine hydrobromide(1:1), 4-(5-chloro-2-methylsulfanylphenyl)-N,N-dimethyl-4-phenylbutan-1-amine hydrobromide, 4-[5-Chloro-2-(methylsulfanyl)phenyl]-N,N-dimethyl-4-phenylbutan-1-amine--hydrogen bromide (1/1)
| Molecular Formula | C19H25BrClNS |
|---|---|
| Molecular Weight | 413.06 g/mol |
| LogP | 6.11 |
| Topological Polar Surface Area | 28.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 413.05795 |
| Heavy Atoms | 23 |
| Complexity | 304.0 |
Chemical Identifiers
| CAS Number | 899-55-8 |
|---|---|
| SMILES | CN(C)CCCC(C1=CC=CC=C1)C2=C(C=CC(=C2)Cl)SC.Br |
| InChIKey | WIONZPZNUZGNAL-UHFFFAOYSA-N |
Product Overview
C19H24ClNS.BrH (CAS 899-55-8), with molecular formula C19H25BrClNS and molecular weight 413.06 g/mol. IUPAC: 4-(5-chloro-2-methylsulfanylphenyl)-N,N-dimethyl-4-phenylbutan-1-amine;hydrobromide.
Chemical Property Profile of C19H24ClNS.BrH
Property Insights of C19H24ClNS.BrH
The XLogP value of 6.11 indicates that C19H24ClNS.BrH is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.5 Ų, C19H24ClNS.BrH exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C19H24ClNS.BrH has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C19H24ClNS.BrH?
The CAS number of C19H24ClNS.BrH is 899-55-8.
What is the molecular formula of C19H24ClNS.BrH?
The molecular formula of C19H24ClNS.BrH is C19H25BrClNS.
What is the molecular weight of C19H24ClNS.BrH?
The molecular weight of C19H24ClNS.BrH is 413.06 g/mol.
Where can I buy C19H24ClNS.BrH?
You can request a quote for C19H24ClNS.BrH directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C19H24ClNS.BrH?
Yes, KEHONG BIO provides custom synthesis services for C19H24ClNS.BrH and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.