RefChem:315221
TL;DR: RefChem:315221 (CAS 75883-57-7) is a chemical compound with molecular formula C18H24N2O9 and molecular weight 412.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[6-[2-(ethylamino)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]acetamide;oxalic acid
Also Known As: C16H22N2O5.C2H2O4.1/3H2O, N-(4,7-Dimethoxy-6-(2-(ethylamino)ethoxy)-5-benzofuranyl)acetamide oxalate hydrate, C16-H22-N2-O5.C2-H2-O4.1/3H2-O, Acetamide, N-(4,7-dimethoxy-6-(2-(ethylamino)ethoxy)-5-benzofuranyl)-, oxalate, hydrate (3:3:1), N-[6-(2-ethylaminoethoxy)-4,7-dimethoxy-1-benzofuran-5-yl]acetamide; oxalic acid
| Molecular Formula | C18H24N2O9 |
|---|---|
| Molecular Weight | 412.15 g/mol |
| LogP | 1.55 |
| Topological Polar Surface Area | 157.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 412.1482 |
| Heavy Atoms | 29 |
| Complexity | 453.0 |
Chemical Identifiers
| CAS Number | 75883-57-7 |
|---|---|
| SMILES | CCNCCOC1=C(C2=C(C=CO2)C(=C1NC(=O)C)OC)OC.C(=O)(C(=O)O)O |
| InChIKey | KLKGDDJOBUPKIL-UHFFFAOYSA-N |
Product Overview
RefChem:315221 (CAS 75883-57-7), with molecular formula C18H24N2O9 and molecular weight 412.15 g/mol. IUPAC: N-[6-[2-(ethylamino)ethoxy]-4,7-dimethoxy-1-benzofuran-5-yl]acetamide;oxalic acid.
Chemical Property Profile of RefChem:315221
Property Insights of RefChem:315221
The XLogP value of 1.55 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:315221. The TPSA of 157.0 Ų indicates high polarity, suggesting RefChem:315221 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:315221 has 4 hydrogen bond donor(s) and 10 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:315221?
The CAS number of RefChem:315221 is 75883-57-7.
What is the molecular formula of RefChem:315221?
The molecular formula of RefChem:315221 is C18H24N2O9.
What is the molecular weight of RefChem:315221?
The molecular weight of RefChem:315221 is 412.15 g/mol.
Where can I buy RefChem:315221?
You can request a quote for RefChem:315221 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:315221?
Yes, KEHONG BIO provides custom synthesis services for RefChem:315221 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.