RefChem:349139
TL;DR: RefChem:349139 (CAS 74758-26-2) is a chemical compound with molecular formula C27H41Cl3N4 and molecular weight 526.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-chloro-3-(4-methylphenyl)indol-1-yl]-[2-(diethylazaniumyl)ethyl]amino]ethyl-diethylazanium dichloride
Also Known As: Indole, 1-(bis(2-(diethylamino)ethyl)amino)-5-chloro-3-(p-tolyl)-, dihydrochloride, 1-(Bis(2-(diethylamino)ethyl)amino)-5-chloro-3-(p-tolyl)indole dihydrochloride, 2-[[5-chloro-3-(4-methylphenyl)indol-1-yl]-[2-(diethylazaniumyl)ethyl]amino]ethyl-diethylazanium dichloride, RefChem:349139
| Molecular Formula | C27H41Cl3N4 |
|---|---|
| Molecular Weight | 526.24 g/mol |
| LogP | -2.93 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 526.2397 |
| Heavy Atoms | 34 |
| Complexity | 500.0 |
Chemical Identifiers
| CAS Number | 74758-26-2 |
|---|---|
| SMILES | CC[NH+](CC)CCN(CC[NH+](CC)CC)N1C=C(C2=C1C=CC(=C2)Cl)C3=CC=C(C=C3)C.[Cl-].[Cl-] |
| InChIKey | PHGZPCUJQDRYJU-UHFFFAOYSA-N |
Product Overview
RefChem:349139 (CAS 74758-26-2), with molecular formula C27H41Cl3N4 and molecular weight 526.24 g/mol. IUPAC: 2-[[5-chloro-3-(4-methylphenyl)indol-1-yl]-[2-(diethylazaniumyl)ethyl]amino]ethyl-diethylazanium dichloride.
Chemical Property Profile of RefChem:349139
Property Insights of RefChem:349139
The XLogP value of -2.93 indicates that RefChem:349139 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 17.1 Ų, RefChem:349139 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:349139 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:349139?
The CAS number of RefChem:349139 is 74758-26-2.
What is the molecular formula of RefChem:349139?
The molecular formula of RefChem:349139 is C27H41Cl3N4.
What is the molecular weight of RefChem:349139?
The molecular weight of RefChem:349139 is 526.24 g/mol.
Where can I buy RefChem:349139?
You can request a quote for RefChem:349139 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:349139?
Yes, KEHONG BIO provides custom synthesis services for RefChem:349139 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.