![5-(3,4-Dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine structure](/static/products/3156/315693-42-6.webp)
5-(3,4-Dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine
TL;DR: 5-(3,4-Dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine (CAS 315693-42-6) is a chemical compound with molecular formula C21H15F3N2OS and molecular weight 400.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,4-dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine
Also Known As: 5-(3,4-dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine, AF-399/15128551, 5-(3,4-dimethylphenyl)thieno[2,3-d]pyrimidin-4-yl 3-(trifluoromethyl)phenyl ether
| Molecular Formula | C21H15F3N2OS |
|---|---|
| Molecular Weight | 400.09 g/mol |
| LogP | 6.78624 |
| Topological Polar Surface Area | 35.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 400.08572 |
| Heavy Atoms | 28 |
| Complexity | 1167.9897 |
Chemical Identifiers
| CAS Number | 315693-42-6 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=CSC3=NC=NC(=C23)OC4=CC=CC(=C4)C(F)(F)F)C |
Product Overview
5-(3,4-Dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine (CAS 315693-42-6), with molecular formula C21H15F3N2OS and molecular weight 400.09 g/mol. IUPAC: 5-(3,4-dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine.
Chemical Property Profile of 5-(3,4-Dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine
Property Insights of 5-(3,4-Dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine
The XLogP value of 6.78624 indicates that 5-(3,4-Dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.01 Ų, 5-(3,4-Dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(3,4-Dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-(3,4-Dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine?
The CAS number of 5-(3,4-Dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine is 315693-42-6.
What is the molecular formula of 5-(3,4-Dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine?
The molecular formula of 5-(3,4-Dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine is C21H15F3N2OS.
What is the molecular weight of 5-(3,4-Dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine?
The molecular weight of 5-(3,4-Dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine is 400.09 g/mol.
Where can I buy 5-(3,4-Dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine?
You can request a quote for 5-(3,4-Dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(3,4-Dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 5-(3,4-Dimethylphenyl)-4-[3-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.