K832-4068
TL;DR: K832-4068 (CAS 698384-03-1) is a chemical compound with molecular formula C19H15BrClFN4O and molecular weight 448.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(5-bromo-2-fluorophenyl)-5-(3-chloro-4-ethoxyphenyl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
Also Known As: K832-4068, 7-(5-bromo-2-fluorophenyl)-5-(3-chloro-4-ethoxyphenyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine, 7-(5-bromo-2-fluorophenyl)-5-(3-chloro-4-ethoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
| Molecular Formula | C19H15BrClFN4O |
|---|---|
| Molecular Weight | 448.01 g/mol |
| LogP | 5.2878 |
| Topological Polar Surface Area | 51.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 448.0102 |
| Heavy Atoms | 27 |
| Complexity | 1036.2992 |
Chemical Identifiers
| CAS Number | 698384-03-1 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C2=CC(N3C(=NC=N3)N2)C4=C(C=CC(=C4)Br)F)Cl |
Product Overview
K832-4068 (CAS 698384-03-1), with molecular formula C19H15BrClFN4O and molecular weight 448.01 g/mol. IUPAC: 7-(5-bromo-2-fluorophenyl)-5-(3-chloro-4-ethoxyphenyl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine.
Chemical Property Profile of K832-4068
Property Insights of K832-4068
The XLogP value of 5.2878 indicates that K832-4068 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.97 Ų, K832-4068 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, K832-4068 has 1 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 K832-4068?
The CAS number of K832-4068 is 698384-03-1.
What is the molecular formula of K832-4068?
The molecular formula of K832-4068 is C19H15BrClFN4O.
What is the molecular weight of K832-4068?
The molecular weight of K832-4068 is 448.01 g/mol.
Where can I buy K832-4068?
You can request a quote for K832-4068 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for K832-4068?
Yes, KEHONG BIO provides custom synthesis services for K832-4068 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.