RefChem:349142
TL;DR: RefChem:349142 (CAS 57647-56-0) is a chemical compound with molecular formula C22H30Cl3FN4 and molecular weight 474.152 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[3-(4-chlorophenyl)-5-fluoroindol-1-yl]-[2-(dimethylazaniumyl)ethyl]amino]ethyl-dimethylazanium dichloride
Also Known As: Indole, 1-(bis(2-(dimethylamino)ethyl)amino)-3-(p-chlorophenyl)-5-fluoro-, dihydrochloride, 1-(Bis(2-(dimethylamino)ethyl)amino)-3-(p-chlorophenyl)-5-fluoroindole dihydrochloride, 2-[[3-(4-chlorophenyl)-5-fluoroindol-1-yl]-[2-(dimethylazaniumyl)ethyl]amino]ethyl-dimethylazanium dichloride
Technical Specifications
| Molecular Formula | C22H30Cl3FN4 |
| Molecular Weight | 474.152 g/mol |
| XLogP | -4.66 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 474.152 Da |
| Heavy Atoms | 30 |
| Complexity | 457.0 |
| SMILES | C[NH+](C)CCN(CC[NH+](C)C)N1C=C(C2=C1C=CC(=C2)F)C3=CC=C(C=C3)Cl.[Cl-].[Cl-] |
| InChIKey | RTIZWXZVQUDDCL-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:349142
Property Insights of RefChem:349142
The XLogP value of -4.66 indicates that RefChem:349142 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:349142 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:349142 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:349142?
The CAS number of RefChem:349142 is 57647-56-0.
What is the molecular formula of RefChem:349142?
The molecular formula of RefChem:349142 is C22H30Cl3FN4.
What is the molecular weight of RefChem:349142?
The molecular weight of RefChem:349142 is 474.152 g/mol.
Where can I buy RefChem:349142?
You can request a quote for RefChem:349142 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:349142?
Yes, CoreyChem provides custom synthesis services for RefChem:349142 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.