![1-Methylethyl 2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate structure](/static/products/4382/438219-87-5.webp)
1-Methylethyl 2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate
TL;DR: 1-Methylethyl 2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate (CAS 438219-87-5) is a chemical compound with molecular formula C23H26N2O5S and molecular weight 442.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-[(3,5-dimethyl-1,2-oxazole-4-carbonyl)amino]-4-(4-ethoxyphenyl)-5-methylthiophene-3-carboxylate
Also Known As: 1-Methylethyl 2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate, isopropyl 2-{[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino}-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate, propan-2-yl 2-[(3,5-dimethyl-1,2-oxazole-4-carbonyl)amino]-4-(4-ethoxyphenyl)-5-methylthiophene-3-carboxylate, propan-2-yl 2-{[(3,5-dimethyl-1,2-oxazol-4-yl)carbonyl]amino}-4-(4-ethoxyphenyl)-5-methylthiophene-3-carboxylate, methylethyl 2-[(3,5-dimethylisoxazol-4-yl)carbonylamino]-4-(4-ethoxyphenyl)-5- methylthiophene-3-carboxylate
| Molecular Formula | C23H26N2O5S |
|---|---|
| Molecular Weight | 442.16 g/mol |
| LogP | 5.54456 |
| Topological Polar Surface Area | 90.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 442.15625 |
| Heavy Atoms | 31 |
| Complexity | 1076.6174 |
Chemical Identifiers
| CAS Number | 438219-87-5 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC(C)C)NC(=O)C3=C(ON=C3C)C)C |
Product Overview
1-Methylethyl 2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate (CAS 438219-87-5), with molecular formula C23H26N2O5S and molecular weight 442.16 g/mol. IUPAC: propan-2-yl 2-[(3,5-dimethyl-1,2-oxazole-4-carbonyl)amino]-4-(4-ethoxyphenyl)-5-methylthiophene-3-carboxylate.
Chemical Property Profile of 1-Methylethyl 2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate
Property Insights of 1-Methylethyl 2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate
The XLogP value of 5.54456 indicates that 1-Methylethyl 2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methylethyl 2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate. Following Lipinski's Rule of Five, 1-Methylethyl 2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Methylethyl 2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate?
The CAS number of 1-Methylethyl 2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate is 438219-87-5.
What is the molecular formula of 1-Methylethyl 2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate?
The molecular formula of 1-Methylethyl 2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate is C23H26N2O5S.
What is the molecular weight of 1-Methylethyl 2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate?
The molecular weight of 1-Methylethyl 2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate is 442.16 g/mol.
Where can I buy 1-Methylethyl 2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate?
You can request a quote for 1-Methylethyl 2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methylethyl 2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 1-Methylethyl 2-[[(3,5-dimethyl-4-isoxazolyl)carbonyl]amino]-4-(4-ethoxyphenyl)-5-methyl-3-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.