ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate
TL;DR: ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate (CAS 445232-81-5) is a chemical compound with molecular formula C23H24N2O4S2 and molecular weight 456.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate
Also Known As: ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate, ethyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-methyl-5-(2-toluidinocarbonyl)-3-thiophenecarboxylate, ethyl 2-(4,5-dimethylthiophene-3-carboxamido)-4-methyl-5-(o-tolylcarbamoyl)thiophene-3-carboxylate, ethyl 2-[(4,5-dimethyl(3-thienyl))carbonylamino]-4-methyl-5-[N-(2-methylphenyl )carbamoyl]thiophene-3-carboxylate, ethyl 2-{[(4,5-dimethylthiophen-3-yl)carbonyl]amino}-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate
| Molecular Formula | C23H24N2O4S2 |
|---|---|
| Molecular Weight | 456.12 g/mol |
| LogP | 5.72458 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 456.11774 |
| Heavy Atoms | 31 |
| Complexity | 1160.5358 |
Chemical Identifiers
| CAS Number | 445232-81-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2C)NC(=O)C3=CSC(=C3C)C |
Product Overview
ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate (CAS 445232-81-5), with molecular formula C23H24N2O4S2 and molecular weight 456.12 g/mol. IUPAC: ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate.
Chemical Property Profile of ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate
Property Insights of ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate
The XLogP value of 5.72458 indicates that ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate. Following Lipinski's Rule of Five, ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate has 2 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 ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate?
The CAS number of ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate is 445232-81-5.
What is the molecular formula of ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate?
The molecular formula of ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate is C23H24N2O4S2.
What is the molecular weight of ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate?
The molecular weight of ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate is 456.12 g/mol.
Where can I buy ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate?
You can request a quote for ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.