RefChem:349149
TL;DR: RefChem:349149 (CAS 57647-55-9) is a chemical compound with molecular formula C24H34Cl4N4 and molecular weight 518.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[5-chloro-3-(4-chlorophenyl)indol-1-yl]-[3-(dimethylazaniumyl)propyl]amino]propyl-dimethylazanium dichloride
Also Known As: Indole, 1-(bis(3-(dimethylamino)propyl)amino)-5-chloro-3-(p-chlorophenyl)-, dihydrochloride, 1-(Bis(3-(dimethylamino)propyl)amino)-5-chloro-3-(p-chlorophenyl)indole dihydrochloride, 3-[[5-chloro-3-(4-chlorophenyl)indol-1-yl]-[3-(dimethylazaniumyl)propyl]amino]propyl-dimethylazanium dichloride, RefChem:349149
| Molecular Formula | C24H34Cl4N4 |
|---|---|
| Molecular Weight | 518.15 g/mol |
| LogP | -3.37 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 520.1508 |
| Heavy Atoms | 32 |
| Complexity | 482.0 |
Chemical Identifiers
| CAS Number | 57647-55-9 |
|---|---|
| SMILES | C[NH+](C)CCCN(CCC[NH+](C)C)N1C=C(C2=C1C=CC(=C2)Cl)C3=CC=C(C=C3)Cl.[Cl-].[Cl-] |
| InChIKey | KJKZGOHZOCATOO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:349149 (CAS 57647-55-9), with molecular formula C24H34Cl4N4 and molecular weight 518.15 g/mol. IUPAC: 3-[[5-chloro-3-(4-chlorophenyl)indol-1-yl]-[3-(dimethylazaniumyl)propyl]amino]propyl-dimethylazanium dichloride.
Chemical Property Profile of RefChem:349149
Property Insights of RefChem:349149
The XLogP value of -3.37 indicates that RefChem:349149 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:349149 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:349149 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:349149?
The CAS number of RefChem:349149 is 57647-55-9.
What is the molecular formula of RefChem:349149?
The molecular formula of RefChem:349149 is C24H34Cl4N4.
What is the molecular weight of RefChem:349149?
The molecular weight of RefChem:349149 is 518.15 g/mol.
Where can I buy RefChem:349149?
You can request a quote for RefChem:349149 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:349149?
Yes, KEHONG BIO provides custom synthesis services for RefChem:349149 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.