2-(4-Butoxyphenyl)-5-(4-hydroxyphenyl)pyrimidine
TL;DR: 2-(4-Butoxyphenyl)-5-(4-hydroxyphenyl)pyrimidine (CAS 137780-31-5) is a chemical compound with molecular formula C20H20N2O2 and molecular weight 320.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(4-butoxyphenyl)pyrimidin-5-yl]phenol
Also Known As: LCRC-1 cpd, 4-[2-(4-butoxyphenyl)pyrimidin-5-yl]phenol, Phenol, 4-[2-(4-butoxyphenyl)-5-pyrimidinyl]-, 4-[2-(4-Butoxyphenyl)-5-pyrimidinyl]phenol, 2-(4-butoxyphenyl)-5-(4-hydroxyphenyl)pyrimidine
| Molecular Formula | C20H20N2O2 |
|---|---|
| Molecular Weight | 320.15 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 55.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 320.15247 |
| Heavy Atoms | 24 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 137780-31-5 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)O |
| InChIKey | CNDUVHIFNJWFPD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Butoxyphenyl)-5-(4-hydroxyphenyl)pyrimidine (CAS 137780-31-5), with molecular formula C20H20N2O2 and molecular weight 320.15 g/mol. IUPAC: 4-[2-(4-butoxyphenyl)pyrimidin-5-yl]phenol.
Chemical Property Profile of 2-(4-Butoxyphenyl)-5-(4-hydroxyphenyl)pyrimidine
Property Insights of 2-(4-Butoxyphenyl)-5-(4-hydroxyphenyl)pyrimidine
The XLogP value of 4.4 indicates that 2-(4-Butoxyphenyl)-5-(4-hydroxyphenyl)pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.2 Ų, 2-(4-Butoxyphenyl)-5-(4-hydroxyphenyl)pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Butoxyphenyl)-5-(4-hydroxyphenyl)pyrimidine has 1 hydrogen bond donor(s) and 4 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 2-(4-Butoxyphenyl)-5-(4-hydroxyphenyl)pyrimidine?
The CAS number of 2-(4-Butoxyphenyl)-5-(4-hydroxyphenyl)pyrimidine is 137780-31-5.
What is the molecular formula of 2-(4-Butoxyphenyl)-5-(4-hydroxyphenyl)pyrimidine?
The molecular formula of 2-(4-Butoxyphenyl)-5-(4-hydroxyphenyl)pyrimidine is C20H20N2O2.
What is the molecular weight of 2-(4-Butoxyphenyl)-5-(4-hydroxyphenyl)pyrimidine?
The molecular weight of 2-(4-Butoxyphenyl)-5-(4-hydroxyphenyl)pyrimidine is 320.15 g/mol.
Where can I buy 2-(4-Butoxyphenyl)-5-(4-hydroxyphenyl)pyrimidine?
You can request a quote for 2-(4-Butoxyphenyl)-5-(4-hydroxyphenyl)pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Butoxyphenyl)-5-(4-hydroxyphenyl)pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Butoxyphenyl)-5-(4-hydroxyphenyl)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.