(4-Bromophenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone
TL;DR: (4-Bromophenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone (CAS 371948-39-9) is a chemical compound with molecular formula C16H9BrN2O7 and molecular weight 419.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromophenyl)-(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone
Also Known As: (4-bromophenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone, (4-bromophenyl)-(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone, (4-bromophenyl)-(5-hydroxy-2-methyl-4,6-dinitro-benzofuran-3-yl)methanone, (4-bromophenyl)(5-hydroxy-2-methyl-4,6-dinitrobenzofuran-3-yl)methanone, (4-bromophenyl)-(5-hydroxy-2-methyl-4,6-dinitro-3-benzofuranyl)methanone
| Molecular Formula | C16H9BrN2O7 |
|---|---|
| Molecular Weight | 419.96 g/mol |
| LogP | 4.25672 |
| Topological Polar Surface Area | 136.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 419.95932 |
| Heavy Atoms | 26 |
| Complexity | 1086.4116 |
Chemical Identifiers
| CAS Number | 371948-39-9 |
|---|---|
| SMILES | CC1=C(C2=C(O1)C=C(C(=C2[N+](=O)[O-])O)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)Br |
Product Overview
(4-Bromophenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone (CAS 371948-39-9), with molecular formula C16H9BrN2O7 and molecular weight 419.96 g/mol. IUPAC: (4-bromophenyl)-(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone.
Chemical Property Profile of (4-Bromophenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone
Property Insights of (4-Bromophenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone
The XLogP value of 4.25672 indicates that (4-Bromophenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 136.72 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Bromophenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone. Following Lipinski's Rule of Five, (4-Bromophenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone 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 (4-Bromophenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone?
The CAS number of (4-Bromophenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone is 371948-39-9.
What is the molecular formula of (4-Bromophenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone?
The molecular formula of (4-Bromophenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone is C16H9BrN2O7.
What is the molecular weight of (4-Bromophenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone?
The molecular weight of (4-Bromophenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone is 419.96 g/mol.
Where can I buy (4-Bromophenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone?
You can request a quote for (4-Bromophenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Bromophenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-Bromophenyl)(5-hydroxy-2-methyl-4,6-dinitro-1-benzofuran-3-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.