3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide
TL;DR: 3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide (CAS 620586-92-7) is a chemical compound with molecular formula C17H14N2O4 and molecular weight 310.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide
Also Known As: 3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide, 3,5-dimethyl-N-(2-nitrophenyl)benzofuran-2-carboxamide, VU0508856-1, F3088-4569, N-o-nitrophenyl-3,5-dimethyl-1-benzofuran-2-carboxamide
| Molecular Formula | C17H14N2O4 |
|---|---|
| Molecular Weight | 310.10 g/mol |
| LogP | 4.21014 |
| Topological Polar Surface Area | 85.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 310.09537 |
| Heavy Atoms | 23 |
| Complexity | 927.4881 |
Chemical Identifiers
| CAS Number | 620586-92-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)OC(=C2C)C(=O)NC3=CC=CC=C3[N+](=O)[O-] |
Product Overview
3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide (CAS 620586-92-7), with molecular formula C17H14N2O4 and molecular weight 310.10 g/mol. IUPAC: 3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide.
Chemical Property Profile of 3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide
Property Insights of 3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide
The XLogP value of 4.21014 indicates that 3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide. Following Lipinski's Rule of Five, 3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide has 1 hydrogen bond donor(s) and 4 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 3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide?
The CAS number of 3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide is 620586-92-7.
What is the molecular formula of 3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide?
The molecular formula of 3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide is C17H14N2O4.
What is the molecular weight of 3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide?
The molecular weight of 3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide is 310.10 g/mol.
Where can I buy 3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide?
You can request a quote for 3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3,5-dimethyl-N-(2-nitrophenyl)-1-benzofuran-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.