![5-[2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoylamino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide structure](/static/products/1005/1005694-42-7.webp)
5-[2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoylamino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide
TL;DR: 5-[2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoylamino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide (CAS 1005694-42-7) is a chemical compound with molecular formula C17H18BrF2N5O2S and molecular weight 473.03326 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoylamino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide
Also Known As: 5-[2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoylamino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide, 5-({2-[4-BROMO-3-(DIFLUOROMETHYL)-5-METHYL-1H-PYRAZOL-1-YL]PROPANOYL}AMINO)-4-CYANO-N,N,3-TRIMETHYL-2-THIOPHENECARBOXAMIDE, 5-({2-[4-bromo-3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]propanoyl}amino)-4-cyano-N,N,3-trimethylthiophene-2-carboxamide
Technical Specifications
| Molecular Formula | C17H18BrF2N5O2S |
| Molecular Weight | 473.03326 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 119.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 473.03326 Da |
| Heavy Atoms | 28 |
| Complexity | 661.0 |
| SMILES | CC1=C(SC(=C1C#N)NC(=O)C(C)N2C(=C(C(=N2)C(F)F)Br)C)C(=O)N(C)C |
| InChIKey | LFDFGROGKGWEEH-UHFFFAOYSA-N |
Chemical Property Profile of 5-[2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoylamino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide
Property Insights of 5-[2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoylamino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide
The XLogP value of 3.8 indicates that 5-[2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoylamino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoylamino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide. Following Lipinski's Rule of Five, 5-[2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoylamino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-[2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoylamino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide?
The CAS number of 5-[2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoylamino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide is 1005694-42-7.
What is the molecular formula of 5-[2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoylamino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide?
The molecular formula of 5-[2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoylamino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide is C17H18BrF2N5O2S.
What is the molecular weight of 5-[2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoylamino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide?
The molecular weight of 5-[2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoylamino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide is 473.03326 g/mol.
Where can I buy 5-[2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoylamino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide?
You can request a quote for 5-[2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoylamino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-[2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoylamino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide?
Yes, CoreyChem provides custom synthesis services for 5-[2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]propanoylamino]-4-cyano-N,N,3-trimethylthiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.