isopropyl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methyl-3-thiophenecarboxylate
TL;DR: isopropyl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methyl-3-thiophenecarboxylate (CAS 445037-72-9) is a chemical compound with molecular formula C25H27NO4S and molecular weight 437.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methylthiophene-3-carboxylate
Also Known As: isopropyl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methyl-3-thiophenecarboxylate, propan-2-yl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methylthiophene-3-carboxylate, ISOPROPYL 4-(2,5-DIMETHYLPHENYL)-2-(4-METHOXYBENZAMIDO)-5-METHYLTHIOPHENE-3-CARBOXYLATE, methylethyl 4-(2,5-dimethylphenyl)-2-[(4-methoxyphenyl)carbonylamino]-5-methyl thiophene-3-carboxylate, propan-2-yl 4-(2,5-dimethylphenyl)-2-{[(4-methoxyphenyl)carbonyl]amino}-5-methylthiophene-3-carboxylate
| Molecular Formula | C25H27NO4S |
|---|---|
| Molecular Weight | 437.17 g/mol |
| LogP | 6.16646 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 437.16608 |
| Heavy Atoms | 31 |
| Complexity | 1113.2958 |
Chemical Identifiers
| CAS Number | 445037-72-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)C2=C(SC(=C2C(=O)OC(C)C)NC(=O)C3=CC=C(C=C3)OC)C |
Product Overview
isopropyl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methyl-3-thiophenecarboxylate (CAS 445037-72-9), with molecular formula C25H27NO4S and molecular weight 437.17 g/mol. IUPAC: propan-2-yl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methylthiophene-3-carboxylate.
Chemical Property Profile of isopropyl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methyl-3-thiophenecarboxylate
Property Insights of isopropyl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methyl-3-thiophenecarboxylate
The XLogP value of 6.16646 indicates that isopropyl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methyl-3-thiophenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for isopropyl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methyl-3-thiophenecarboxylate. Following Lipinski's Rule of Five, isopropyl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methyl-3-thiophenecarboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of isopropyl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methyl-3-thiophenecarboxylate?
The CAS number of isopropyl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methyl-3-thiophenecarboxylate is 445037-72-9.
What is the molecular formula of isopropyl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methyl-3-thiophenecarboxylate?
The molecular formula of isopropyl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methyl-3-thiophenecarboxylate is C25H27NO4S.
What is the molecular weight of isopropyl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methyl-3-thiophenecarboxylate?
The molecular weight of isopropyl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methyl-3-thiophenecarboxylate is 437.17 g/mol.
Where can I buy isopropyl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methyl-3-thiophenecarboxylate?
You can request a quote for isopropyl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-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 isopropyl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methyl-3-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for isopropyl 4-(2,5-dimethylphenyl)-2-[(4-methoxybenzoyl)amino]-5-methyl-3-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.