RefChem:366340
TL;DR: RefChem:366340 (CAS 102489-55-4) is a chemical compound with molecular formula C18H31Cl2N3O and molecular weight 375.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-(2-chloro-6-methylanilino)-2-oxoethyl]-propylamino]ethyl-diethylazanium chloride
Also Known As: C 5385, 6'-Chloro-2-((2-(diethylamino)ethyl)propylamino)-o-acetotoluidide hydrochloride, o-Acetotoluidide, 6'-chloro-2-((2-(diethylamino)ethyl)propylamino)-, hydrochloride, 2-[[2-(2-chloro-6-methylanilino)-2-oxoethyl]-propylamino]ethyl-diethylazanium chloride, 2-[{2-[(2-chloro-6-methylphenyl)amino]-2-oxoethyl}(propyl)amino]-n,n-diethylethanaminium chloride
| Molecular Formula | C18H31Cl2N3O |
|---|---|
| Molecular Weight | 375.18 g/mol |
| LogP | -0.77 |
| Topological Polar Surface Area | 36.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 375.18442 |
| Heavy Atoms | 24 |
| Complexity | 336.0 |
Chemical Identifiers
| CAS Number | 102489-55-4 |
|---|---|
| SMILES | CCCN(CC[NH+](CC)CC)CC(=O)NC1=C(C=CC=C1Cl)C.[Cl-] |
| InChIKey | SZLPCPVKQKRUBE-UHFFFAOYSA-N |
Product Overview
RefChem:366340 (CAS 102489-55-4), with molecular formula C18H31Cl2N3O and molecular weight 375.18 g/mol. IUPAC: 2-[[2-(2-chloro-6-methylanilino)-2-oxoethyl]-propylamino]ethyl-diethylazanium chloride.
Chemical Property Profile of RefChem:366340
Property Insights of RefChem:366340
The XLogP value of -0.77 indicates that RefChem:366340 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 36.8 Ų, RefChem:366340 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:366340 has 2 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 RefChem:366340?
The CAS number of RefChem:366340 is 102489-55-4.
What is the molecular formula of RefChem:366340?
The molecular formula of RefChem:366340 is C18H31Cl2N3O.
What is the molecular weight of RefChem:366340?
The molecular weight of RefChem:366340 is 375.18 g/mol.
Where can I buy RefChem:366340?
You can request a quote for RefChem:366340 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:366340?
Yes, KEHONG BIO provides custom synthesis services for RefChem:366340 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.