TL;DR: Indole, 1-(bis(2-(dimethylamino)ethyl)amino)-5-fluoro-3-phenyl-, dihydrochloride (CAS 57647-51-5) is a chemical compound with molecular formula C22H31Cl2FN4 and molecular weight 440.19098 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(dimethylazaniumyl)ethyl-(5-fluoro-3-phenylindol-1-yl)amino]ethyl-dimethylazanium dichloride
Also Known As: 1-(Bis(2-(dimethylamino)ethyl)amino)-5-fluoro-3-phenylindole dihydrochloride, INDOLE, 1-(BIS(2-(DIMETHYLAMINO)ETHYL)AMINO)-5-FLUORO-3-PHENYL-, DIHYDROCHLORIDE, 2-[2-(dimethylazaniumyl)ethyl-(5-fluoro-3-phenylindol-1-yl)amino]ethyl-dimethylazanium dichloride
| Molecular Formula | C22H31Cl2FN4 |
| Molecular Weight | 440.19098 g/mol |
| XLogP | -5.32 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 440.19098 Da |
| Heavy Atoms | 29 |
| Complexity | 426.0 |
| SMILES | C[NH+](C)CCN(CC[NH+](C)C)N1C=C(C2=C1C=CC(=C2)F)C3=CC=CC=C3.[Cl-].[Cl-] |
| InChIKey | CFBIHJIUTJCJLQ-UHFFFAOYSA-N |
The XLogP value of -5.32 indicates that Indole, 1-(bis(2-(dimethylamino)ethyl)amino)-5-fluoro-3-phenyl-, dihydrochloride 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, Indole, 1-(bis(2-(dimethylamino)ethyl)amino)-5-fluoro-3-phenyl-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indole, 1-(bis(2-(dimethylamino)ethyl)amino)-5-fluoro-3-phenyl-, dihydrochloride has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Indole, 1-(bis(2-(dimethylamino)ethyl)amino)-5-fluoro-3-phenyl-, dihydrochloride is 57647-51-5.
The molecular formula of Indole, 1-(bis(2-(dimethylamino)ethyl)amino)-5-fluoro-3-phenyl-, dihydrochloride is C22H31Cl2FN4.
The molecular weight of Indole, 1-(bis(2-(dimethylamino)ethyl)amino)-5-fluoro-3-phenyl-, dihydrochloride is 440.19098 g/mol.
You can request a quote for Indole, 1-(bis(2-(dimethylamino)ethyl)amino)-5-fluoro-3-phenyl-, dihydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Yes, CoreyChem provides custom synthesis services for Indole, 1-(bis(2-(dimethylamino)ethyl)amino)-5-fluoro-3-phenyl-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.
Request a quote for CAS 57647-51-5. Our professional technical team will respond with pricing and lead time.