![6,7-dimethoxy-3-[(4-nitrophenyl)amino]-2-benzofuran-1(3H)-one structure](/static/products/300/300588-25-4.png)
6,7-dimethoxy-3-[(4-nitrophenyl)amino]-2-benzofuran-1(3H)-one
TL;DR: 6,7-dimethoxy-3-[(4-nitrophenyl)amino]-2-benzofuran-1(3H)-one (CAS 300588-25-4) is a chemical compound with molecular formula C16H14N2O6 and molecular weight 330.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dimethoxy-3-(4-nitroanilino)-3H-2-benzofuran-1-one
Also Known As: 6,7-dimethoxy-3-(4-nitroanilino)-3H-2-benzofuran-1-one, 6,7-dimethoxy-3-((4-nitrophenyl)amino)isobenzofuran-1(3H)-one, 6,7-dimethoxy-3-[(4-nitrophenyl)amino]-2-benzofuran-1(3H)-one, 6,7-dimethoxy-3-[(4-nitrophenyl)amino]-3-hydroisobenzofuran-1-one
| Molecular Formula | C16H14N2O6 |
|---|---|
| Molecular Weight | 330.09 g/mol |
| LogP | 2.8931 |
| Topological Polar Surface Area | 99.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 330.08517 |
| Heavy Atoms | 24 |
| Complexity | 802.9601 |
Chemical Identifiers
| CAS Number | 300588-25-4 |
|---|---|
| SMILES | COC1=C(C2=C(C=C1)C(OC2=O)NC3=CC=C(C=C3)[N+](=O)[O-])OC |
Product Overview
6,7-dimethoxy-3-[(4-nitrophenyl)amino]-2-benzofuran-1(3H)-one (CAS 300588-25-4), with molecular formula C16H14N2O6 and molecular weight 330.09 g/mol. IUPAC: 6,7-dimethoxy-3-(4-nitroanilino)-3H-2-benzofuran-1-one.
Chemical Property Profile of 6,7-dimethoxy-3-[(4-nitrophenyl)amino]-2-benzofuran-1(3H)-one
Property Insights of 6,7-dimethoxy-3-[(4-nitrophenyl)amino]-2-benzofuran-1(3H)-one
The XLogP value of 2.8931 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7-dimethoxy-3-[(4-nitrophenyl)amino]-2-benzofuran-1(3H)-one. The TPSA of 99.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 6,7-dimethoxy-3-[(4-nitrophenyl)amino]-2-benzofuran-1(3H)-one. Following Lipinski's Rule of Five, 6,7-dimethoxy-3-[(4-nitrophenyl)amino]-2-benzofuran-1(3H)-one has 1 hydrogen bond donor(s) and 7 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 6,7-dimethoxy-3-[(4-nitrophenyl)amino]-2-benzofuran-1(3H)-one?
The CAS number of 6,7-dimethoxy-3-[(4-nitrophenyl)amino]-2-benzofuran-1(3H)-one is 300588-25-4.
What is the molecular formula of 6,7-dimethoxy-3-[(4-nitrophenyl)amino]-2-benzofuran-1(3H)-one?
The molecular formula of 6,7-dimethoxy-3-[(4-nitrophenyl)amino]-2-benzofuran-1(3H)-one is C16H14N2O6.
What is the molecular weight of 6,7-dimethoxy-3-[(4-nitrophenyl)amino]-2-benzofuran-1(3H)-one?
The molecular weight of 6,7-dimethoxy-3-[(4-nitrophenyl)amino]-2-benzofuran-1(3H)-one is 330.09 g/mol.
Where can I buy 6,7-dimethoxy-3-[(4-nitrophenyl)amino]-2-benzofuran-1(3H)-one?
You can request a quote for 6,7-dimethoxy-3-[(4-nitrophenyl)amino]-2-benzofuran-1(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-dimethoxy-3-[(4-nitrophenyl)amino]-2-benzofuran-1(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 6,7-dimethoxy-3-[(4-nitrophenyl)amino]-2-benzofuran-1(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.