![methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate structure](/static/products/4450/445014-22-2.webp)
methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate
TL;DR: methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate (CAS 445014-22-2) is a chemical compound with molecular formula C22H20ClN3O4S and molecular weight 457.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate
Also Known As: methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate, methyl 2-{[(2-chloro-3-pyridinyl)carbonyl]amino}-5-[(2,4-dimethylanilino)carbonyl]-4-methyl-3-thiophenecarboxylate, methyl 2-{[(2-chloropyridin-3-yl)carbonyl]amino}-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate, methyl 5-[N-(2,4-dimethylphenyl)carbamoyl]-2-[(2-chloro(3-pyridyl))carbonylami no]-4-methylthiophene-3-carboxylate
| Molecular Formula | C22H20ClN3O4S |
|---|---|
| Molecular Weight | 457.09 g/mol |
| LogP | 5.01296 |
| Topological Polar Surface Area | 97.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 457.0863 |
| Heavy Atoms | 31 |
| Complexity | 1189.4943 |
Chemical Identifiers
| CAS Number | 445014-22-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC(=O)C2=C(C(=C(S2)NC(=O)C3=C(N=CC=C3)Cl)C(=O)OC)C)C |
Product Overview
methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate (CAS 445014-22-2), with molecular formula C22H20ClN3O4S and molecular weight 457.09 g/mol. IUPAC: methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate.
Chemical Property Profile of methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate
Property Insights of methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate
The XLogP value of 5.01296 indicates that methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.39 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate. Following Lipinski's Rule of Five, methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-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 methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate?
The CAS number of methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate is 445014-22-2.
What is the molecular formula of methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate?
The molecular formula of methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate is C22H20ClN3O4S.
What is the molecular weight of methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate?
The molecular weight of methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate is 457.09 g/mol.
Where can I buy methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate?
You can request a quote for methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-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 methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-[(2-chloropyridine-3-carbonyl)amino]-5-[(2,4-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.