5-Octyl-2-(4-(octyloxy)phenyl)pyrimidine
TL;DR: 5-Octyl-2-(4-(octyloxy)phenyl)pyrimidine (CAS 57202-50-3) is a chemical compound with molecular formula C26H40N2O and molecular weight 396.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-octoxyphenyl)-5-octylpyrimidine
Also Known As: 5-Octyl-2-(4-(octyloxy)phenyl)pyrimidine, 2-(4-octoxyphenyl)-5-octylpyrimidine, ChemDiv1_018949, DivK1c_003733, 5-OCTYL-2- PYRIMIDINE
| Molecular Formula | C26H40N2O |
|---|---|
| Molecular Weight | 396.31 g/mol |
| LogP | 7.7859 |
| Topological Polar Surface Area | 35.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 16 |
| Exact Mass | 396.31406 |
| Heavy Atoms | 29 |
| Complexity | 636.7628 |
Chemical Identifiers
| CAS Number | 57202-50-3 |
|---|---|
| SMILES | CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCCCCCC |
Product Overview
5-Octyl-2-(4-(octyloxy)phenyl)pyrimidine (CAS 57202-50-3), with molecular formula C26H40N2O and molecular weight 396.31 g/mol. IUPAC: 2-(4-octoxyphenyl)-5-octylpyrimidine.
Chemical Property Profile of 5-Octyl-2-(4-(octyloxy)phenyl)pyrimidine
Property Insights of 5-Octyl-2-(4-(octyloxy)phenyl)pyrimidine
The XLogP value of 7.7859 indicates that 5-Octyl-2-(4-(octyloxy)phenyl)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-Octyl-2-(4-(octyloxy)phenyl)pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Octyl-2-(4-(octyloxy)phenyl)pyrimidine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Octyl-2-(4-(octyloxy)phenyl)pyrimidine?
The CAS number of 5-Octyl-2-(4-(octyloxy)phenyl)pyrimidine is 57202-50-3.
What is the molecular formula of 5-Octyl-2-(4-(octyloxy)phenyl)pyrimidine?
The molecular formula of 5-Octyl-2-(4-(octyloxy)phenyl)pyrimidine is C26H40N2O.
What is the molecular weight of 5-Octyl-2-(4-(octyloxy)phenyl)pyrimidine?
The molecular weight of 5-Octyl-2-(4-(octyloxy)phenyl)pyrimidine is 396.31 g/mol.
Where can I buy 5-Octyl-2-(4-(octyloxy)phenyl)pyrimidine?
You can request a quote for 5-Octyl-2-(4-(octyloxy)phenyl)pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Octyl-2-(4-(octyloxy)phenyl)pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 5-Octyl-2-(4-(octyloxy)phenyl)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.