RefChem:326488
TL;DR: RefChem:326488 (CAS 100347-66-8) is a chemical compound with molecular formula C15H22Cl2N2O and molecular weight 316.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-[2-(6,7,8,9-tetrahydro-[1]benzofuro[3,2-c]pyridin-2-ium-8-yl)ethyl]azanium dichloride
Also Known As: Benzofuro(3,2-c)pyridine, 1,2,3,4-tetrahydro-2-(2-(dimethylamino)ethyl)-, dihydrochloride, 2-(2-(Dimethylamino)ethyl)-1,2,3,4-tetrahydrobenzofuro(3,2-c)pyridine dihydrochloride, 2-(3,4-Dihydrobenzofuro[3,2-c]pyridin-2(1H)-yl)-N,N-dimethylethanamine dihydrochloride, 2-(3,4-dihydro-1H-[1]benzofuro[3,2-c]pyridin-2-yl)-N,N-dimethylethanamine,dihydrochloride, 8-[2-(dimethylammonio)ethyl]-6,7,8,9-tetrahydro[1]benzofuro[3,2-c]pyridin-2-ium dichloride
| Molecular Formula | C15H22Cl2N2O |
|---|---|
| Molecular Weight | 316.11 g/mol |
| LogP | -5.11 |
| Topological Polar Surface Area | 31.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.11093 |
| Heavy Atoms | 20 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 100347-66-8 |
|---|---|
| SMILES | C[NH+](C)CCC1CCC2=C(C1)C3=C(O2)C=C[NH+]=C3.[Cl-].[Cl-] |
| InChIKey | GFZBKCSDMQNKIY-UHFFFAOYSA-N |
Product Overview
RefChem:326488 (CAS 100347-66-8), with molecular formula C15H22Cl2N2O and molecular weight 316.11 g/mol. IUPAC: dimethyl-[2-(6,7,8,9-tetrahydro-[1]benzofuro[3,2-c]pyridin-2-ium-8-yl)ethyl]azanium dichloride.
Chemical Property Profile of RefChem:326488
Property Insights of RefChem:326488
The XLogP value of -5.11 indicates that RefChem:326488 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 31.7 Ų, RefChem:326488 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:326488 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:326488?
The CAS number of RefChem:326488 is 100347-66-8.
What is the molecular formula of RefChem:326488?
The molecular formula of RefChem:326488 is C15H22Cl2N2O.
What is the molecular weight of RefChem:326488?
The molecular weight of RefChem:326488 is 316.11 g/mol.
Where can I buy RefChem:326488?
You can request a quote for RefChem:326488 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:326488?
Yes, KEHONG BIO provides custom synthesis services for RefChem:326488 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.