![4-Chloro-2-{[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]amino}benzenol structure](/static/products/2407/240799-66-0.webp)
4-Chloro-2-{[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]amino}benzenol
TL;DR: 4-Chloro-2-{[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]amino}benzenol (CAS 240799-66-0) is a chemical compound with molecular formula C12H10ClN3O4 and molecular weight 295.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenylamino]phenol
Also Known As: 4-chloro-2-{[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]amino}benzenol, 4-chloro-2-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenylamino]phenol, 4-chloro-2-[[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]amino]phenol
| Molecular Formula | C12H10ClN3O4 |
|---|---|
| Molecular Weight | 295.04 g/mol |
| LogP | 3.33302 |
| Topological Polar Surface Area | 101.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.03598 |
| Heavy Atoms | 20 |
| Complexity | 681.3371 |
Chemical Identifiers
| CAS Number | 240799-66-0 |
|---|---|
| SMILES | CC1=NOC(=C1[N+](=O)[O-])C=CNC2=C(C=CC(=C2)Cl)O |
Product Overview
4-Chloro-2-{[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]amino}benzenol (CAS 240799-66-0), with molecular formula C12H10ClN3O4 and molecular weight 295.04 g/mol. IUPAC: 4-chloro-2-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenylamino]phenol.
Chemical Property Profile of 4-Chloro-2-{[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]amino}benzenol
Property Insights of 4-Chloro-2-{[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]amino}benzenol
The XLogP value of 3.33302 indicates that 4-Chloro-2-{[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]amino}benzenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-2-{[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]amino}benzenol. Following Lipinski's Rule of Five, 4-Chloro-2-{[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]amino}benzenol has 2 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 4-Chloro-2-{[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]amino}benzenol?
The CAS number of 4-Chloro-2-{[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]amino}benzenol is 240799-66-0.
What is the molecular formula of 4-Chloro-2-{[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]amino}benzenol?
The molecular formula of 4-Chloro-2-{[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]amino}benzenol is C12H10ClN3O4.
What is the molecular weight of 4-Chloro-2-{[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]amino}benzenol?
The molecular weight of 4-Chloro-2-{[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]amino}benzenol is 295.04 g/mol.
Where can I buy 4-Chloro-2-{[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]amino}benzenol?
You can request a quote for 4-Chloro-2-{[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]amino}benzenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-2-{[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]amino}benzenol?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-2-{[2-(3-methyl-4-nitro-5-isoxazolyl)vinyl]amino}benzenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.