RefChem:334051
TL;DR: RefChem:334051 (CAS 69782-35-0) is a chemical compound with molecular formula C18H25ClN2O3 and molecular weight 352.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methoxy-2,3-dimethyl-8-[(4-methylpiperazin-4-ium-1-yl)methyl]chromen-4-one chloride
Also Known As: Chromone, 2,3-dimethyl-7-methoxy-8-(4-methyl-1-piperazinyl)methyl-, hydrochloride, 2,3-Dimethyl-7-methoxy-8-(4-methyl-1-piperazinyl)methylchromone hydrochloride, 4H-1-Benzopyran-4-one, 7-methoxy-2,3-dimethyl-8-((4-methyl-1-piperazinyl)methyl)-, HCl, 7-methoxy-2,3-dimethyl-8-[(4-methylpiperazin-4-ium-1-yl)methyl]chromen-4-one chloride, RefChem:334051
| Molecular Formula | C18H25ClN2O3 |
|---|---|
| Molecular Weight | 352.16 g/mol |
| LogP | -2.25 |
| Topological Polar Surface Area | 43.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.15536 |
| Heavy Atoms | 24 |
| Complexity | 483.0 |
Chemical Identifiers
| CAS Number | 69782-35-0 |
|---|---|
| SMILES | CC1=C(OC2=C(C1=O)C=CC(=C2CN3CC[NH+](CC3)C)OC)C.[Cl-] |
| InChIKey | IIRUSNNBEVJFJK-UHFFFAOYSA-N |
Product Overview
RefChem:334051 (CAS 69782-35-0), with molecular formula C18H25ClN2O3 and molecular weight 352.16 g/mol. IUPAC: 7-methoxy-2,3-dimethyl-8-[(4-methylpiperazin-4-ium-1-yl)methyl]chromen-4-one chloride.
Chemical Property Profile of RefChem:334051
Property Insights of RefChem:334051
The XLogP value of -2.25 indicates that RefChem:334051 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 43.2 Ų, RefChem:334051 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:334051 has 1 hydrogen bond donor(s) and 5 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:334051?
The CAS number of RefChem:334051 is 69782-35-0.
What is the molecular formula of RefChem:334051?
The molecular formula of RefChem:334051 is C18H25ClN2O3.
What is the molecular weight of RefChem:334051?
The molecular weight of RefChem:334051 is 352.16 g/mol.
Where can I buy RefChem:334051?
You can request a quote for RefChem:334051 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:334051?
Yes, KEHONG BIO provides custom synthesis services for RefChem:334051 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.