RefChem:309552
TL;DR: RefChem:309552 (CAS 18833-77-7) is a chemical compound with molecular formula C19H28Cl3N3 and molecular weight 403.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3-chloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-5-ium-11-yl)amino]propyl-dimethylazanium dichloride
Also Known As: 6H-Cyclohepta(b)quinoline, 3-chloro-11-((3-(dimethylamino)propyl)amino)-7,8,9,10-tetrahydro-, dihydrochloride, 3-[(3-chloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-5-ium-11-yl)amino]propyl-dimethylazanium dichloride, 6H-CYCLOHEPTA(b)QUINOLINE, 3-CHLORO-11-((3-(DIMETHYLAMINO)PROPYL)AMINO)-7,8,9,10, RefChem:309552
| Molecular Formula | C19H28Cl3N3 |
|---|---|
| Molecular Weight | 403.13 g/mol |
| LogP | -3.47 |
| Topological Polar Surface Area | 30.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.1349 |
| Heavy Atoms | 25 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 18833-77-7 |
|---|---|
| SMILES | C[NH+](C)CCCNC1=C2CCCCCC2=[NH+]C3=C1C=CC(=C3)Cl.[Cl-].[Cl-] |
| InChIKey | PHJXPINJGAIMQP-UHFFFAOYSA-N |
Product Overview
RefChem:309552 (CAS 18833-77-7), with molecular formula C19H28Cl3N3 and molecular weight 403.13 g/mol. IUPAC: 3-[(3-chloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-5-ium-11-yl)amino]propyl-dimethylazanium dichloride.
Chemical Property Profile of RefChem:309552
Property Insights of RefChem:309552
The XLogP value of -3.47 indicates that RefChem:309552 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 30.6 Ų, RefChem:309552 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:309552 has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:309552?
The CAS number of RefChem:309552 is 18833-77-7.
What is the molecular formula of RefChem:309552?
The molecular formula of RefChem:309552 is C19H28Cl3N3.
What is the molecular weight of RefChem:309552?
The molecular weight of RefChem:309552 is 403.13 g/mol.
Where can I buy RefChem:309552?
You can request a quote for RefChem:309552 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:309552?
Yes, KEHONG BIO provides custom synthesis services for RefChem:309552 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.