N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine
TL;DR: N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine (CAS 352544-84-4) is a chemical compound with molecular formula C15H11N3O5 and molecular weight 313.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine
Also Known As: BAS 00744964, N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine, (2,5-Dinitro-benzofuran-3-yl)-p-tolyl-amine
| Molecular Formula | C15H11N3O5 |
|---|---|
| Molecular Weight | 313.07 g/mol |
| LogP | 4.30122 |
| Topological Polar Surface Area | 111.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 313.0699 |
| Heavy Atoms | 23 |
| Complexity | 914.7571 |
Chemical Identifiers
| CAS Number | 352544-84-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC2=C(OC3=C2C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine (CAS 352544-84-4), with molecular formula C15H11N3O5 and molecular weight 313.07 g/mol. IUPAC: N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine.
Chemical Property Profile of N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine
Property Insights of N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine
The XLogP value of 4.30122 indicates that N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.45 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine. Following Lipinski's Rule of Five, N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine has 1 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 N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine?
The CAS number of N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine is 352544-84-4.
What is the molecular formula of N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine?
The molecular formula of N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine is C15H11N3O5.
What is the molecular weight of N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine?
The molecular weight of N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine is 313.07 g/mol.
Where can I buy N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine?
You can request a quote for N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(4-methylphenyl)-2,5-dinitro-1-benzofuran-3-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.