![propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate structure](/static/products/4382/438212-97-6.webp)
propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate
TL;DR: propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate (CAS 438212-97-6) is a chemical compound with molecular formula C31H33NO6S and molecular weight 547.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate
Also Known As: propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate, propyl 4-(4-tert-butylphenyl)-2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-5-methyl-3-thiophenecarboxylate, propyl 4-(4-(tert-butyl)phenyl)-2-(8-ethoxy-2-oxo-2H-chromene-3-carboxamido)-5-methylthiophene-3-carboxylate, propyl 4-(4-tert-butylphenyl)-2-{[(8-ethoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-5-methylthiophene-3-carboxylate, propyl 4-[4-(tert-butyl)phenyl]-2-[(8-ethoxy-2-oxochromen-3-yl)carbonylamino]- 5-methylthiophene-3-carboxylate
| Molecular Formula | C31H33NO6S |
|---|---|
| Molecular Weight | 547.20 g/mol |
| LogP | 7.34522 |
| Topological Polar Surface Area | 94.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 547.2029 |
| Heavy Atoms | 39 |
| Complexity | 1573.9052 |
Chemical Identifiers
| CAS Number | 438212-97-6 |
|---|---|
| SMILES | CCCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)C(C)(C)C)C)NC(=O)C3=CC4=C(C(=CC=C4)OCC)OC3=O |
Product Overview
propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate (CAS 438212-97-6), with molecular formula C31H33NO6S and molecular weight 547.20 g/mol. IUPAC: propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate.
Chemical Property Profile of propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate
Property Insights of propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate
The XLogP value of 7.34522 indicates that propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.84 Ų falls within the moderate polarity range, balancing permeability and solubility for propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate. Following Lipinski's Rule of Five, propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate 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 propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate?
The CAS number of propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate is 438212-97-6.
What is the molecular formula of propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate?
The molecular formula of propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate is C31H33NO6S.
What is the molecular weight of propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate?
The molecular weight of propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate is 547.20 g/mol.
Where can I buy propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate?
You can request a quote for propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for propyl 4-(4-tert-butylphenyl)-2-[(8-ethoxy-2-oxochromene-3-carbonyl)amino]-5-methylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.