RefChem:309531
TL;DR: RefChem:309531 (CAS 18833-74-4) is a chemical compound with molecular formula C18H27Cl2N3 and molecular weight 355.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-[2-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-ylazaniumyl)ethyl]azanium dichloride
Also Known As: 6H-Cyclohepta(b)quinoline, 11-((2-(diethylamino)ethyl)amino)-7,8,9,10-tetrahydro-, dihydrochloride, 11-((2-(Dimethylamino)ethyl)amino)-7,8,9,10-tetrahydro-6H-cyclohepta(b)quinoline 2HCl, N'-(7,8,9,10-Tetrahydro-6H-cyclohepta(b)quinolin-11-yl)-N,N-dimethyl-1,2-ethanediamine 2HCl, 2-(Dimethylazaniumyl)ethyl-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)azanium dichloride, 6H-CYCLOHEPTA(b)QUINOLINE, 11-((2-(DIETHYLAMINO)ETHYL)AMINO)-7,8,9,10-TETRAHYDRO
| Molecular Formula | C18H27Cl2N3 |
|---|---|
| Molecular Weight | 355.16 g/mol |
| LogP | -5.15 |
| Topological Polar Surface Area | 33.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 355.1582 |
| Heavy Atoms | 23 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 18833-74-4 |
|---|---|
| SMILES | C[NH+](C)CC[NH2+]C1=C2CCCCCC2=NC3=CC=CC=C31.[Cl-].[Cl-] |
| InChIKey | KYBYPCPSZPFYRZ-UHFFFAOYSA-N |
Product Overview
RefChem:309531 (CAS 18833-74-4), with molecular formula C18H27Cl2N3 and molecular weight 355.16 g/mol. IUPAC: dimethyl-[2-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-ylazaniumyl)ethyl]azanium dichloride.
Chemical Property Profile of RefChem:309531
Property Insights of RefChem:309531
The XLogP value of -5.15 indicates that RefChem:309531 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 33.9 Ų, RefChem:309531 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:309531 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
Frequently Asked Questions
What is the CAS number of RefChem:309531?
The CAS number of RefChem:309531 is 18833-74-4.
What is the molecular formula of RefChem:309531?
The molecular formula of RefChem:309531 is C18H27Cl2N3.
What is the molecular weight of RefChem:309531?
The molecular weight of RefChem:309531 is 355.16 g/mol.
Where can I buy RefChem:309531?
You can request a quote for RefChem:309531 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:309531?
Yes, KEHONG BIO provides custom synthesis services for RefChem:309531 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.