![propyl 4-(4-tert-butylphenyl)-2-({[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate structure](/static/products/4450/445018-16-6.webp)
propyl 4-(4-tert-butylphenyl)-2-({[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate
TL;DR: propyl 4-(4-tert-butylphenyl)-2-({[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate (CAS 445018-16-6) is a chemical compound with molecular formula C30H30Cl2N2O4S and molecular weight 584.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 4-(4-tert-butylphenyl)-2-[[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-5-methylthiophene-3-carboxylate
Also Known As: propyl 4-(4-tert-butylphenyl)-2-({[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate, propyl 4-(4-tert-butylphenyl)-2-[[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-5-methylthiophene-3-carboxylate, propyl 4-(4-(tert-butyl)phenyl)-2-(3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxamido)-5-methylthiophene-3-carboxylate, propyl 4-(4-tert-butylphenyl)-2-({[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate, PROPYL 4-[4-(TERT-BUTYL)PHENYL]-2-({[3-(2,6-DICHLOROPHENYL)-5-METHYL-4-ISOXAZOLYL]CARBONYL}AMINO)-5-METHYL-3-THIOPHENECARBOXYLATE
| Molecular Formula | C30H30Cl2N2O4S |
|---|---|
| Molecular Weight | 584.13 g/mol |
| LogP | 9.11034 |
| Topological Polar Surface Area | 81.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 584.1303 |
| Heavy Atoms | 39 |
| Complexity | 1511.5204 |
Chemical Identifiers
| CAS Number | 445018-16-6 |
|---|---|
| SMILES | CCCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)C(C)(C)C)C)NC(=O)C3=C(ON=C3C4=C(C=CC=C4Cl)Cl)C |
Product Overview
propyl 4-(4-tert-butylphenyl)-2-({[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate (CAS 445018-16-6), with molecular formula C30H30Cl2N2O4S and molecular weight 584.13 g/mol. IUPAC: propyl 4-(4-tert-butylphenyl)-2-[[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-5-methylthiophene-3-carboxylate.
Chemical Property Profile of propyl 4-(4-tert-butylphenyl)-2-({[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate
Property Insights of propyl 4-(4-tert-butylphenyl)-2-({[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate
The XLogP value of 9.11034 indicates that propyl 4-(4-tert-butylphenyl)-2-({[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.43 Ų falls within the moderate polarity range, balancing permeability and solubility for propyl 4-(4-tert-butylphenyl)-2-({[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate. Following Lipinski's Rule of Five, propyl 4-(4-tert-butylphenyl)-2-({[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate has 1 hydrogen bond donor(s) and 6 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-({[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate?
The CAS number of propyl 4-(4-tert-butylphenyl)-2-({[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate is 445018-16-6.
What is the molecular formula of propyl 4-(4-tert-butylphenyl)-2-({[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate?
The molecular formula of propyl 4-(4-tert-butylphenyl)-2-({[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate is C30H30Cl2N2O4S.
What is the molecular weight of propyl 4-(4-tert-butylphenyl)-2-({[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate?
The molecular weight of propyl 4-(4-tert-butylphenyl)-2-({[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate is 584.13 g/mol.
Where can I buy propyl 4-(4-tert-butylphenyl)-2-({[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate?
You can request a quote for propyl 4-(4-tert-butylphenyl)-2-({[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]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-({[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for propyl 4-(4-tert-butylphenyl)-2-({[3-(2,6-dichlorophenyl)-5-methylisoxazol-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.