5-Isoxazolamine, 3-(2-furanyl)-N-((5-nitro-2-thienyl)methylene)-
TL;DR: 5-Isoxazolamine, 3-(2-furanyl)-N-((5-nitro-2-thienyl)methylene)- (CAS 37853-19-3) is a chemical compound with molecular formula C12H7N3O4S and molecular weight 289.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[3-(furan-2-yl)-1,2-oxazol-5-yl]-1-(5-nitrothiophen-2-yl)methanimine
Also Known As: 3-(2-Furanyl)-N-((5-nitro-2-thienyl)methylene)-5-isoxazolamine, 5-Isoxazolamine, 3-(2-furanyl)-N-((5-nitro-2-thienyl)methylene)-, 3-(Furan-2-yl)-N-((5-nitrothiophen-2-yl)methylene)isoxazol-5-amine, 5-Isoxazolamine,3-(2-furanyl)-N-[(5-nitro-2-thienyl)methylene]-, RefChem:1073037
| Molecular Formula | C12H7N3O4S |
|---|---|
| Molecular Weight | 289.02 g/mol |
| LogP | 3.6549 |
| Topological Polar Surface Area | 94.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.01572 |
| Heavy Atoms | 20 |
| Complexity | 757.374 |
Chemical Identifiers
| CAS Number | 37853-19-3 |
|---|---|
| SMILES | C1=COC(=C1)C2=NOC(=C2)/N=C/C3=CC=C(S3)[N+](=O)[O-] |
Product Overview
5-Isoxazolamine, 3-(2-furanyl)-N-((5-nitro-2-thienyl)methylene)- (CAS 37853-19-3), with molecular formula C12H7N3O4S and molecular weight 289.02 g/mol. IUPAC: (E)-N-[3-(furan-2-yl)-1,2-oxazol-5-yl]-1-(5-nitrothiophen-2-yl)methanimine.
Chemical Property Profile of 5-Isoxazolamine, 3-(2-furanyl)-N-((5-nitro-2-thienyl)methylene)-
Property Insights of 5-Isoxazolamine, 3-(2-furanyl)-N-((5-nitro-2-thienyl)methylene)-
The XLogP value of 3.6549 indicates that 5-Isoxazolamine, 3-(2-furanyl)-N-((5-nitro-2-thienyl)methylene)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Isoxazolamine, 3-(2-furanyl)-N-((5-nitro-2-thienyl)methylene)-. Following Lipinski's Rule of Five, 5-Isoxazolamine, 3-(2-furanyl)-N-((5-nitro-2-thienyl)methylene)- has 0 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 5-Isoxazolamine, 3-(2-furanyl)-N-((5-nitro-2-thienyl)methylene)-?
The CAS number of 5-Isoxazolamine, 3-(2-furanyl)-N-((5-nitro-2-thienyl)methylene)- is 37853-19-3.
What is the molecular formula of 5-Isoxazolamine, 3-(2-furanyl)-N-((5-nitro-2-thienyl)methylene)-?
The molecular formula of 5-Isoxazolamine, 3-(2-furanyl)-N-((5-nitro-2-thienyl)methylene)- is C12H7N3O4S.
What is the molecular weight of 5-Isoxazolamine, 3-(2-furanyl)-N-((5-nitro-2-thienyl)methylene)-?
The molecular weight of 5-Isoxazolamine, 3-(2-furanyl)-N-((5-nitro-2-thienyl)methylene)- is 289.02 g/mol.
Where can I buy 5-Isoxazolamine, 3-(2-furanyl)-N-((5-nitro-2-thienyl)methylene)-?
You can request a quote for 5-Isoxazolamine, 3-(2-furanyl)-N-((5-nitro-2-thienyl)methylene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Isoxazolamine, 3-(2-furanyl)-N-((5-nitro-2-thienyl)methylene)-?
Yes, KEHONG BIO provides custom synthesis services for 5-Isoxazolamine, 3-(2-furanyl)-N-((5-nitro-2-thienyl)methylene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.