![5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide structure](/static/products/4450/445014-42-6.webp)
5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide
TL;DR: 5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide (CAS 445014-42-6) is a chemical compound with molecular formula C18H18ClN3O3S and molecular weight 391.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide
Also Known As: 5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide, 5-[[2-(4-chloro-2-methyl-phenoxy)acetyl]amino]-4-cyano-N,N,3-trimethyl-thiophene-2-carboxamide, 5-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide, 5-[2-(4-CHLORO-2-METHYLPHENOXY)ACETAMIDO]-4-CYANO-NN3-TRIMETHYLTHIOPHENE-2-CARBOXAMIDE, N-[5-(N,N-dimethylcarbamoyl)-3-cyano-4-methyl(2-thienyl)]-2-(4-chloro-2-methyl phenoxy)acetamide
| Molecular Formula | C18H18ClN3O3S |
|---|---|
| Molecular Weight | 391.08 g/mol |
| LogP | 3.60932 |
| Topological Polar Surface Area | 82.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 391.07574 |
| Heavy Atoms | 26 |
| Complexity | 899.8168 |
Chemical Identifiers
| CAS Number | 445014-42-6 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)OCC(=O)NC2=C(C(=C(S2)C(=O)N(C)C)C)C#N |
Product Overview
5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide (CAS 445014-42-6), with molecular formula C18H18ClN3O3S and molecular weight 391.08 g/mol. IUPAC: 5-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide.
Chemical Property Profile of 5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide
Property Insights of 5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide
The XLogP value of 3.60932 indicates that 5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide. Following Lipinski's Rule of Five, 5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide?
The CAS number of 5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide is 445014-42-6.
What is the molecular formula of 5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide?
The molecular formula of 5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide is C18H18ClN3O3S.
What is the molecular weight of 5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide?
The molecular weight of 5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide is 391.08 g/mol.
Where can I buy 5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide?
You can request a quote for 5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-{[(4-chloro-2-methylphenoxy)acetyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.