![2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate structure](/static/products/7442/744245-07-6.webp)
2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate
TL;DR: 2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate (CAS 744245-07-6) is a chemical compound with molecular formula C20H19N3O7S and molecular weight 445.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl] 3-[(4-methoxyphenyl)sulfamoyl]benzoate
Also Known As: 2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate, [2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl] 3-[(4-methoxyphenyl)sulfamoyl]benzoate, 2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl 3-[(4-methoxyphenyl)sulfamoyl]benzoate
| Molecular Formula | C20H19N3O7S |
|---|---|
| Molecular Weight | 445.09 g/mol |
| LogP | 2.58792 |
| Topological Polar Surface Area | 136.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 445.09436 |
| Heavy Atoms | 31 |
| Complexity | 1187.4923 |
Chemical Identifiers
| CAS Number | 744245-07-6 |
|---|---|
| SMILES | CC1=CC(=NO1)NC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)NC3=CC=C(C=C3)OC |
Product Overview
2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate (CAS 744245-07-6), with molecular formula C20H19N3O7S and molecular weight 445.09 g/mol. IUPAC: [2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl] 3-[(4-methoxyphenyl)sulfamoyl]benzoate.
Chemical Property Profile of 2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate
Property Insights of 2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate
The XLogP value of 2.58792 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate. The TPSA of 136.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate. Following Lipinski's Rule of Five, 2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate has 2 hydrogen bond donor(s) and 8 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 2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate?
The CAS number of 2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate is 744245-07-6.
What is the molecular formula of 2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate?
The molecular formula of 2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate is C20H19N3O7S.
What is the molecular weight of 2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate?
The molecular weight of 2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate is 445.09 g/mol.
Where can I buy 2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate?
You can request a quote for 2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-[(5-Methyl-3-isoxazolyl)amino]-2-oxoethyl 3-[[(4-methoxyphenyl)amino]sulfonyl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.