![5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine structure](/static/products/672/672893-69-5.png)
5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
TL;DR: 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine (CAS 672893-69-5) is a chemical compound with molecular formula C17H11BrClFN4 and molecular weight 403.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
Also Known As: 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine, 5-(4-bromophenyl)-7-(2-chloro-6-fluoro-phenyl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine, 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine, 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine, 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
| Molecular Formula | C17H11BrClFN4 |
|---|---|
| Molecular Weight | 403.98 g/mol |
| LogP | 4.8891 |
| Topological Polar Surface Area | 42.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 403.98395 |
| Heavy Atoms | 24 |
| Complexity | 915.76855 |
Chemical Identifiers
| CAS Number | 672893-69-5 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)C2C=C(NC3=NC=NN23)C4=CC=C(C=C4)Br)F |
Product Overview
5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine (CAS 672893-69-5), with molecular formula C17H11BrClFN4 and molecular weight 403.98 g/mol. IUPAC: 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine.
Chemical Property Profile of 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Property Insights of 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
The XLogP value of 4.8891 indicates that 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.74 Ų, 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine has 1 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 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine?
The CAS number of 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine is 672893-69-5.
What is the molecular formula of 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine?
The molecular formula of 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine is C17H11BrClFN4.
What is the molecular weight of 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine?
The molecular weight of 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine is 403.98 g/mol.
Where can I buy 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine?
You can request a quote for 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-3,7-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-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.