5-Benzofuranol, 2,4-dibromo-6-(diethylaminomethyl)-3-phenyl-, hydrochloride
TL;DR: 5-Benzofuranol, 2,4-dibromo-6-(diethylaminomethyl)-3-phenyl-, hydrochloride (CAS 69405-79-4) is a chemical compound with molecular formula C19H20Br2ClNO2 and molecular weight 486.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4-dibromo-5-hydroxy-3-phenyl-1-benzofuran-6-yl)methyl-diethylazanium chloride
Also Known As: 2,4-Dibromo-6-(diethylaminomethyl)-3-phenyl-5-benzofuranol hydrochloride, 5-BENZOFURANOL, 2,4-DIBROMO-6-(DIETHYLAMINOMETHYL)-3-PHENYL-, HYDROCHLORIDE, (2,4-Dibromo-5-hydroxy-3-phenyl-1-benzofuran-6-yl)methyl-diethylazaniumchloride, (2,4-dibromo-5-hydroxy-3-phenyl-1-benzofuran-6-yl)methyl-diethylazanium chloride, RefChem:301209
| Molecular Formula | C19H20Br2ClNO2 |
|---|---|
| Molecular Weight | 486.95 g/mol |
| LogP | 1.76 |
| Topological Polar Surface Area | 37.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 488.95288 |
| Heavy Atoms | 25 |
| Complexity | 401.0 |
Chemical Identifiers
| CAS Number | 69405-79-4 |
|---|---|
| SMILES | CC[NH+](CC)CC1=CC2=C(C(=C(O2)Br)C3=CC=CC=C3)C(=C1O)Br.[Cl-] |
| InChIKey | CFIPIFXFKOWASM-UHFFFAOYSA-N |
Product Overview
5-Benzofuranol, 2,4-dibromo-6-(diethylaminomethyl)-3-phenyl-, hydrochloride (CAS 69405-79-4), with molecular formula C19H20Br2ClNO2 and molecular weight 486.95 g/mol. IUPAC: (2,4-dibromo-5-hydroxy-3-phenyl-1-benzofuran-6-yl)methyl-diethylazanium chloride.
Chemical Property Profile of 5-Benzofuranol, 2,4-dibromo-6-(diethylaminomethyl)-3-phenyl-, hydrochloride
Property Insights of 5-Benzofuranol, 2,4-dibromo-6-(diethylaminomethyl)-3-phenyl-, hydrochloride
The XLogP value of 1.76 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Benzofuranol, 2,4-dibromo-6-(diethylaminomethyl)-3-phenyl-, hydrochloride. With a topological polar surface area (TPSA) of 37.8 Ų, 5-Benzofuranol, 2,4-dibromo-6-(diethylaminomethyl)-3-phenyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Benzofuranol, 2,4-dibromo-6-(diethylaminomethyl)-3-phenyl-, 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 5-Benzofuranol, 2,4-dibromo-6-(diethylaminomethyl)-3-phenyl-, hydrochloride?
The CAS number of 5-Benzofuranol, 2,4-dibromo-6-(diethylaminomethyl)-3-phenyl-, hydrochloride is 69405-79-4.
What is the molecular formula of 5-Benzofuranol, 2,4-dibromo-6-(diethylaminomethyl)-3-phenyl-, hydrochloride?
The molecular formula of 5-Benzofuranol, 2,4-dibromo-6-(diethylaminomethyl)-3-phenyl-, hydrochloride is C19H20Br2ClNO2.
What is the molecular weight of 5-Benzofuranol, 2,4-dibromo-6-(diethylaminomethyl)-3-phenyl-, hydrochloride?
The molecular weight of 5-Benzofuranol, 2,4-dibromo-6-(diethylaminomethyl)-3-phenyl-, hydrochloride is 486.95 g/mol.
Where can I buy 5-Benzofuranol, 2,4-dibromo-6-(diethylaminomethyl)-3-phenyl-, hydrochloride?
You can request a quote for 5-Benzofuranol, 2,4-dibromo-6-(diethylaminomethyl)-3-phenyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Benzofuranol, 2,4-dibromo-6-(diethylaminomethyl)-3-phenyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 5-Benzofuranol, 2,4-dibromo-6-(diethylaminomethyl)-3-phenyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.