![N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide structure](/static/products/577/577790-37-5.png)
N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide
TL;DR: N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide (CAS 577790-37-5) is a chemical compound with molecular formula C15H12F3N3O2 and molecular weight 323.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide
Also Known As: N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide, N-(4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl)-2-methylbenzamide, N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl]-2-methylbenzamide
| Molecular Formula | C15H12F3N3O2 |
|---|---|
| Molecular Weight | 323.09 g/mol |
| LogP | 1.9533 |
| Topological Polar Surface Area | 81.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 323.08817 |
| Heavy Atoms | 23 |
| Complexity | 761.966 |
Chemical Identifiers
| CAS Number | 577790-37-5 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)NC2(C(=C(NC2=O)C)C#N)C(F)(F)F |
Product Overview
N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide (CAS 577790-37-5), with molecular formula C15H12F3N3O2 and molecular weight 323.09 g/mol. IUPAC: N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide.
Chemical Property Profile of N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide
Property Insights of N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide
The XLogP value of 1.9533 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide. The TPSA of 81.99 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide. Following Lipinski's Rule of Five, N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide has 2 hydrogen bond donor(s) and 3 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 N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide?
The CAS number of N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide is 577790-37-5.
What is the molecular formula of N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide?
The molecular formula of N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide is C15H12F3N3O2.
What is the molecular weight of N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide?
The molecular weight of N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide is 323.09 g/mol.
Where can I buy N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide?
You can request a quote for N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-2-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.