![4-Amino-5-[(4-bromophenyl)carbonyl]isoxazole-3-carboxamide structure](/static/products/6966/696620-24-3.webp)
4-Amino-5-[(4-bromophenyl)carbonyl]isoxazole-3-carboxamide
TL;DR: 4-Amino-5-[(4-bromophenyl)carbonyl]isoxazole-3-carboxamide (CAS 696620-24-3) is a chemical compound with molecular formula C11H8BrN3O3 and molecular weight 308.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-5-(4-bromobenzoyl)-1,2-oxazole-3-carboxamide
Also Known As: ZERO/005583, 4-Amino-5-(4-bromobenzoyl)-3-isoxazolecarboxamide, 4-amino-5-(4-bromobenzoyl)isoxazole-3-carboxamide, 4-amino-5-(4-bromobenzoyl)-1,2-oxazole-3-carboxamide, 4-amino-5-[(4-bromophenyl)carbonyl]isoxazole-3-carboxamide
| Molecular Formula | C11H8BrN3O3 |
|---|---|
| Molecular Weight | 308.97 g/mol |
| LogP | 1.3492 |
| Topological Polar Surface Area | 112.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.9749 |
| Heavy Atoms | 18 |
| Complexity | 618.96375 |
Chemical Identifiers
| CAS Number | 696620-24-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)C2=C(C(=NO2)C(=O)N)N)Br |
Product Overview
4-Amino-5-[(4-bromophenyl)carbonyl]isoxazole-3-carboxamide (CAS 696620-24-3), with molecular formula C11H8BrN3O3 and molecular weight 308.97 g/mol. IUPAC: 4-amino-5-(4-bromobenzoyl)-1,2-oxazole-3-carboxamide.
Chemical Property Profile of 4-Amino-5-[(4-bromophenyl)carbonyl]isoxazole-3-carboxamide
Property Insights of 4-Amino-5-[(4-bromophenyl)carbonyl]isoxazole-3-carboxamide
The XLogP value of 1.3492 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-5-[(4-bromophenyl)carbonyl]isoxazole-3-carboxamide. The TPSA of 112.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-5-[(4-bromophenyl)carbonyl]isoxazole-3-carboxamide. Following Lipinski's Rule of Five, 4-Amino-5-[(4-bromophenyl)carbonyl]isoxazole-3-carboxamide has 2 hydrogen bond donor(s) and 5 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-Amino-5-[(4-bromophenyl)carbonyl]isoxazole-3-carboxamide?
The CAS number of 4-Amino-5-[(4-bromophenyl)carbonyl]isoxazole-3-carboxamide is 696620-24-3.
What is the molecular formula of 4-Amino-5-[(4-bromophenyl)carbonyl]isoxazole-3-carboxamide?
The molecular formula of 4-Amino-5-[(4-bromophenyl)carbonyl]isoxazole-3-carboxamide is C11H8BrN3O3.
What is the molecular weight of 4-Amino-5-[(4-bromophenyl)carbonyl]isoxazole-3-carboxamide?
The molecular weight of 4-Amino-5-[(4-bromophenyl)carbonyl]isoxazole-3-carboxamide is 308.97 g/mol.
Where can I buy 4-Amino-5-[(4-bromophenyl)carbonyl]isoxazole-3-carboxamide?
You can request a quote for 4-Amino-5-[(4-bromophenyl)carbonyl]isoxazole-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-5-[(4-bromophenyl)carbonyl]isoxazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-5-[(4-bromophenyl)carbonyl]isoxazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.