Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)-
TL;DR: Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)- (CAS 64508-88-9) is a chemical compound with molecular formula C14H21Cl2NS2 and molecular weight 337.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis[2-(2-chloroethylsulfanyl)ethyl]aniline
Also Known As: Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)-, N,N-Bis(2-((2-chloroethyl)thio)ethyl)benzenamine, N,N-bis[2-(2-chloroethylsulfanyl)ethyl]aniline, N,N-bis{2-[(2-chloroethyl)sulfanyl]ethyl}aniline, Benzenamine, N,N-bis[2-[(2-chloroethyl)thio]ethyl]-
| Molecular Formula | C14H21Cl2NS2 |
|---|---|
| Molecular Weight | 337.05 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 53.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 337.04926 |
| Heavy Atoms | 19 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 64508-88-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)N(CCSCCCl)CCSCCCl |
| InChIKey | UGYQSBQAADTCIE-UHFFFAOYSA-N |
Product Overview
Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)- (CAS 64508-88-9), with molecular formula C14H21Cl2NS2 and molecular weight 337.05 g/mol. IUPAC: N,N-bis[2-(2-chloroethylsulfanyl)ethyl]aniline.
Chemical Property Profile of Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)-
Property Insights of Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)-
The XLogP value of 4.2 indicates that Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.8 Ų, Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)- has 0 hydrogen bond donor(s) and 3 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 Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)-?
The CAS number of Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)- is 64508-88-9.
What is the molecular formula of Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)-?
The molecular formula of Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)- is C14H21Cl2NS2.
What is the molecular weight of Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)-?
The molecular weight of Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)- is 337.05 g/mol.
Where can I buy Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)-?
You can request a quote for Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzenamine, N,N-bis(2-((2-chloroethyl)thio)ethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.