![4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}-N-(3-c hloro-4-fluorophenyl)butanamide structure](/static/products/4431/443104-50-5.webp)
4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}-N-(3-c hloro-4-fluorophenyl)butanamide
TL;DR: 4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}-N-(3-c hloro-4-fluorophenyl)butanamide (CAS 443104-50-5) is a chemical compound with molecular formula C23H20ClF4N3O5S and molecular weight 561.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-fluorophenyl)-4-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonylbutanamide
Also Known As: 4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}-N-(3-c hloro-4-fluorophenyl)butanamide, N-(3-Chloro-4-fluorophenyl)-4-((4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl)sulfonyl)butanamide, N-(3-chloro-4-fluorophenyl)-4-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonylbutanamide, N-(3-chloro-4-fluorophenyl)-4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}butanamide
| Molecular Formula | C23H20ClF4N3O5S |
|---|---|
| Molecular Weight | 561.07 g/mol |
| LogP | 5.1647 |
| Topological Polar Surface Area | 107.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 561.0748 |
| Heavy Atoms | 37 |
| Complexity | 1417.976 |
Chemical Identifiers
| CAS Number | 443104-50-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=CC(=NC(=N2)S(=O)(=O)CCCC(=O)NC3=CC(=C(C=C3)F)Cl)C(F)(F)F)OC |
Product Overview
4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}-N-(3-c hloro-4-fluorophenyl)butanamide (CAS 443104-50-5), with molecular formula C23H20ClF4N3O5S and molecular weight 561.07 g/mol. IUPAC: N-(3-chloro-4-fluorophenyl)-4-[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonylbutanamide.
Chemical Property Profile of 4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}-N-(3-c hloro-4-fluorophenyl)butanamide
Property Insights of 4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}-N-(3-c hloro-4-fluorophenyl)butanamide
The XLogP value of 5.1647 indicates that 4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}-N-(3-c hloro-4-fluorophenyl)butanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}-N-(3-c hloro-4-fluorophenyl)butanamide. Following Lipinski's Rule of Five, 4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}-N-(3-c hloro-4-fluorophenyl)butanamide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}-N-(3-c hloro-4-fluorophenyl)butanamide?
The CAS number of 4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}-N-(3-c hloro-4-fluorophenyl)butanamide is 443104-50-5.
What is the molecular formula of 4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}-N-(3-c hloro-4-fluorophenyl)butanamide?
The molecular formula of 4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}-N-(3-c hloro-4-fluorophenyl)butanamide is C23H20ClF4N3O5S.
What is the molecular weight of 4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}-N-(3-c hloro-4-fluorophenyl)butanamide?
The molecular weight of 4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}-N-(3-c hloro-4-fluorophenyl)butanamide is 561.07 g/mol.
Where can I buy 4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}-N-(3-c hloro-4-fluorophenyl)butanamide?
You can request a quote for 4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}-N-(3-c hloro-4-fluorophenyl)butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}-N-(3-c hloro-4-fluorophenyl)butanamide?
Yes, KEHONG BIO provides custom synthesis services for 4-{[4-(3,4-dimethoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl}-N-(3-c hloro-4-fluorophenyl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.