RefChem:365408
TL;DR: RefChem:365408 (CAS 76410-24-7) is a chemical compound with molecular formula C26H28ClNO5 and molecular weight 469.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl-[3-(3-ethoxycarbonyl-2-methylbenzo[g][1]benzofuran-6-yl)oxy-2-hydroxypropyl]azanium chloride
Also Known As: Naphtho(1,2-b)furan-3-carboxylic acid, 6-(2-hydroxy-3-(benzylamino)propoxy)-2-methyl-, ethyl ester, monohydrochloride, benzyl-[3-(3-ethoxycarbonyl-2-methylbenzo[g][1]benzofuran-6-yl)oxy-2-hydroxypropyl]azanium chloride, NAPHTHO(1,2-b)FURAN-3-CARBOXYLIC ACID, 6-(2-HYDROXY-3-(BENZYLAMINO)PROPOXY)-2-ME, benzyl-[3-(3-ethoxycarbonyl-2-methylbenzo[g][1]benzoxol-6-yl)oxy-2-hydroxypropyl]azanium chloride, RefChem:365408
| Molecular Formula | C26H28ClNO5 |
|---|---|
| Molecular Weight | 469.17 g/mol |
| LogP | 0.58 |
| Topological Polar Surface Area | 85.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 469.1656 |
| Heavy Atoms | 33 |
| Complexity | 595.0 |
Chemical Identifiers
| CAS Number | 76410-24-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC2=C1C=CC3=C2C=CC=C3OCC(C[NH2+]CC4=CC=CC=C4)O)C.[Cl-] |
| InChIKey | GJBXSZLRYRCCRS-UHFFFAOYSA-N |
Product Overview
RefChem:365408 (CAS 76410-24-7), with molecular formula C26H28ClNO5 and molecular weight 469.17 g/mol. IUPAC: benzyl-[3-(3-ethoxycarbonyl-2-methylbenzo[g][1]benzofuran-6-yl)oxy-2-hydroxypropyl]azanium chloride.
Chemical Property Profile of RefChem:365408
Property Insights of RefChem:365408
The XLogP value of 0.58 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:365408. The TPSA of 85.5 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:365408. Following Lipinski's Rule of Five, RefChem:365408 has 2 hydrogen bond donor(s) and 6 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:365408?
The CAS number of RefChem:365408 is 76410-24-7.
What is the molecular formula of RefChem:365408?
The molecular formula of RefChem:365408 is C26H28ClNO5.
What is the molecular weight of RefChem:365408?
The molecular weight of RefChem:365408 is 469.17 g/mol.
Where can I buy RefChem:365408?
You can request a quote for RefChem:365408 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:365408?
Yes, KEHONG BIO provides custom synthesis services for RefChem:365408 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.