![5-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine structure](/static/products/6998/6998-36-3.webp)
5-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
TL;DR: 5-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine (CAS 6998-36-3) is a chemical compound with molecular formula C20H17F3N4O2 and molecular weight 402.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
Also Known As: 5-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine, 5-(3,4-Dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
| Molecular Formula | C20H17F3N4O2 |
|---|---|
| Molecular Weight | 402.13 g/mol |
| LogP | 4.3701 |
| Topological Polar Surface Area | 61.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.13037 |
| Heavy Atoms | 29 |
| Complexity | 1058.3334 |
Chemical Identifiers
| CAS Number | 6998-36-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=CC(N3C(=NC=N3)N2)C4=CC=C(C=C4)C(F)(F)F)OC |
Product Overview
5-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine (CAS 6998-36-3), with molecular formula C20H17F3N4O2 and molecular weight 402.13 g/mol. IUPAC: 5-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine.
Chemical Property Profile of 5-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
Property Insights of 5-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
The XLogP value of 4.3701 indicates that 5-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine. Following Lipinski's Rule of Five, 5-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine 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-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine?
The CAS number of 5-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine is 6998-36-3.
What is the molecular formula of 5-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine?
The molecular formula of 5-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine is C20H17F3N4O2.
What is the molecular weight of 5-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine?
The molecular weight of 5-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine is 402.13 g/mol.
Where can I buy 5-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine?
You can request a quote for 5-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]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-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 5-(3,4-dimethoxyphenyl)-7-[4-(trifluoromethyl)phenyl]-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.