RefChem:1058898
TL;DR: RefChem:1058898 (CAS 1099-08-7) is a chemical compound with molecular formula C20H30Cl2N2S2 and molecular weight 432.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-(dimethylamino)-1-phenylethyl]disulfanyl]-N,N-dimethyl-2-phenylethanamine;dihydrochloride
Also Known As: Benzeneethanamine, beta,beta'-dithiobis(N,N-dimethyl-, dihydrochloride, DL-, beta,beta'-Dithiobis(N,N-dimethylbenzeneethanamine) dihydrochloride DL-, 2,2'-Disulfanediylbis(N,N-dimethyl-2-phenylethan-1-amine)--hydrogen chloride (1/2), Benzeneethanamine, beta,beta'-dithiobis(N,N-dimethyl-, dihydrochloride, (R-(R*,R*))-, Benzeneethanamine, beta,beta'-dithiobis(N,N-dimethyl-, dihydrochloride, (S-(R*,R*))-
| Molecular Formula | C20H30Cl2N2S2 |
|---|---|
| Molecular Weight | 432.12 g/mol |
| LogP | 5.82 |
| Topological Polar Surface Area | 57.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 432.12274 |
| Heavy Atoms | 26 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 1099-08-7 |
|---|---|
| SMILES | CN(C)CC(C1=CC=CC=C1)SSC(CN(C)C)C2=CC=CC=C2.Cl.Cl |
| InChIKey | CIYYVJJOQVWDET-UHFFFAOYSA-N |
Product Overview
RefChem:1058898 (CAS 1099-08-7), with molecular formula C20H30Cl2N2S2 and molecular weight 432.12 g/mol. IUPAC: 2-[[2-(dimethylamino)-1-phenylethyl]disulfanyl]-N,N-dimethyl-2-phenylethanamine;dihydrochloride.
Chemical Property Profile of RefChem:1058898
Property Insights of RefChem:1058898
The XLogP value of 5.82 indicates that RefChem:1058898 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.1 Ų, RefChem:1058898 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1058898 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1058898?
The CAS number of RefChem:1058898 is 1099-08-7.
What is the molecular formula of RefChem:1058898?
The molecular formula of RefChem:1058898 is C20H30Cl2N2S2.
What is the molecular weight of RefChem:1058898?
The molecular weight of RefChem:1058898 is 432.12 g/mol.
Where can I buy RefChem:1058898?
You can request a quote for RefChem:1058898 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1058898?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1058898 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.