Isoflavone, 8-(diethylaminomethyl)-7-hydroxy-, hydrochloride
TL;DR: Isoflavone, 8-(diethylaminomethyl)-7-hydroxy-, hydrochloride (CAS 67292-70-0) is a chemical compound with molecular formula C20H22ClNO3 and molecular weight 359.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-[(7-hydroxy-4-oxo-3-phenylchromen-8-yl)methyl]azanium chloride
Also Known As: 8-(Diethylaminomethyl)-7-hydroxyisoflavone hydrochloride, ISOFLAVONE, 8-(DIETHYLAMINOMETHYL)-7-HYDROXY-, HYDROCHLORIDE, diethyl-[(7-hydroxy-4-oxo-3-phenylchromen-8-yl)methyl]azanium chloride, 4H-1-Benzopyran-4-one, 8-[(diethylamino)methyl]-7-hydroxy-3-phenyl-, hydrochloride, RefChem:349602
| Molecular Formula | C20H22ClNO3 |
|---|---|
| Molecular Weight | 359.13 g/mol |
| LogP | -0.4057 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 359.1288 |
| Heavy Atoms | 25 |
| Complexity | 901.9535 |
Chemical Identifiers
| CAS Number | 67292-70-0 |
|---|---|
| SMILES | CC[NH+](CC)CC1=C(C=CC2=C1OC=C(C2=O)C3=CC=CC=C3)O.[Cl-] |
Product Overview
Isoflavone, 8-(diethylaminomethyl)-7-hydroxy-, hydrochloride (CAS 67292-70-0), with molecular formula C20H22ClNO3 and molecular weight 359.13 g/mol. IUPAC: diethyl-[(7-hydroxy-4-oxo-3-phenylchromen-8-yl)methyl]azanium chloride.
Chemical Property Profile of Isoflavone, 8-(diethylaminomethyl)-7-hydroxy-, hydrochloride
Property Insights of Isoflavone, 8-(diethylaminomethyl)-7-hydroxy-, hydrochloride
The XLogP value of -0.4057 indicates that Isoflavone, 8-(diethylaminomethyl)-7-hydroxy-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 54.88 Ų, Isoflavone, 8-(diethylaminomethyl)-7-hydroxy-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoflavone, 8-(diethylaminomethyl)-7-hydroxy-, hydrochloride 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 Isoflavone, 8-(diethylaminomethyl)-7-hydroxy-, hydrochloride?
The CAS number of Isoflavone, 8-(diethylaminomethyl)-7-hydroxy-, hydrochloride is 67292-70-0.
What is the molecular formula of Isoflavone, 8-(diethylaminomethyl)-7-hydroxy-, hydrochloride?
The molecular formula of Isoflavone, 8-(diethylaminomethyl)-7-hydroxy-, hydrochloride is C20H22ClNO3.
What is the molecular weight of Isoflavone, 8-(diethylaminomethyl)-7-hydroxy-, hydrochloride?
The molecular weight of Isoflavone, 8-(diethylaminomethyl)-7-hydroxy-, hydrochloride is 359.13 g/mol.
Where can I buy Isoflavone, 8-(diethylaminomethyl)-7-hydroxy-, hydrochloride?
You can request a quote for Isoflavone, 8-(diethylaminomethyl)-7-hydroxy-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoflavone, 8-(diethylaminomethyl)-7-hydroxy-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Isoflavone, 8-(diethylaminomethyl)-7-hydroxy-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.