RefChem:309546
TL;DR: RefChem:309546 (CAS 18833-70-0) is a chemical compound with molecular formula C19H27Cl3N2S and molecular weight 420.09604 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(2-chloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-5-ium-11-yl)sulfanyl]propyl-dimethylazanium dichloride
Also Known As: 6H-Cyclohepta(b)quinoline, 2-chloro-11-((3-(dimethylamino)propyl)thio)-7,8,9,10-tetrahydro-, dihydrochloride, 3-[(2-chloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-5-ium-11-yl)sulfanyl]propyl-dimethylazanium dichloride, 6H-CYCLOHEPTA(b)QUINOLINE, 2-CHLORO-11-((3-(DIMETHYLAMINO)PROPYL)THIO)-7,8,9,10-
Technical Specifications
| Molecular Formula | C19H27Cl3N2S |
| Molecular Weight | 420.09604 g/mol |
| XLogP | -2.79 |
| Topological Polar Surface Area (TPSA) | 43.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 420.09604 Da |
| Heavy Atoms | 25 |
| Complexity | 365.0 |
| SMILES | C[NH+](C)CCCSC1=C2CCCCCC2=[NH+]C3=C1C=C(C=C3)Cl.[Cl-].[Cl-] |
| InChIKey | FNYNHBCVAUXHSO-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:309546
Property Insights of RefChem:309546
The XLogP value of -2.79 indicates that RefChem:309546 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 43.9 Ų, RefChem:309546 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:309546 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
What is the CAS number of RefChem:309546?
The CAS number of RefChem:309546 is 18833-70-0.
What is the molecular formula of RefChem:309546?
The molecular formula of RefChem:309546 is C19H27Cl3N2S.
What is the molecular weight of RefChem:309546?
The molecular weight of RefChem:309546 is 420.09604 g/mol.
Where can I buy RefChem:309546?
You can request a quote for RefChem:309546 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:309546?
Yes, CoreyChem provides custom synthesis services for RefChem:309546 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.