![2-{4-[4-(4-Methylphenyl)-2-pyrimidinyl]phenoxy}acetonitrile structure](/static/products/4778/477846-94-9.webp)
2-{4-[4-(4-Methylphenyl)-2-pyrimidinyl]phenoxy}acetonitrile
TL;DR: 2-{4-[4-(4-Methylphenyl)-2-pyrimidinyl]phenoxy}acetonitrile (CAS 477846-94-9) is a chemical compound with molecular formula C19H15N3O and molecular weight 301.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[4-(4-methylphenyl)pyrimidin-2-yl]phenoxy]acetonitrile
Also Known As: 2-{4-[4-(4-methylphenyl)-2-pyrimidinyl]phenoxy}acetonitrile, 2-[4-[4-(4-methylphenyl)pyrimidin-2-yl]phenoxy]acetonitrile, 2-{4-[4-(4-methylphenyl)pyrimidin-2-yl]phenoxy}acetonitrile, 10P-155, 2-[4-[4-(p-tolyl)pyrimidin-2-yl]phenoxy]acetonitrile
| Molecular Formula | C19H15N3O |
|---|---|
| Molecular Weight | 301.12 g/mol |
| LogP | 4.0214 |
| Topological Polar Surface Area | 58.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 301.12152 |
| Heavy Atoms | 23 |
| Complexity | 833.7387 |
Chemical Identifiers
| CAS Number | 477846-94-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC(=NC=C2)C3=CC=C(C=C3)OCC#N |
Product Overview
2-{4-[4-(4-Methylphenyl)-2-pyrimidinyl]phenoxy}acetonitrile (CAS 477846-94-9), with molecular formula C19H15N3O and molecular weight 301.12 g/mol. IUPAC: 2-[4-[4-(4-methylphenyl)pyrimidin-2-yl]phenoxy]acetonitrile.
Chemical Property Profile of 2-{4-[4-(4-Methylphenyl)-2-pyrimidinyl]phenoxy}acetonitrile
Property Insights of 2-{4-[4-(4-Methylphenyl)-2-pyrimidinyl]phenoxy}acetonitrile
The XLogP value of 4.0214 indicates that 2-{4-[4-(4-Methylphenyl)-2-pyrimidinyl]phenoxy}acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.8 Ų, 2-{4-[4-(4-Methylphenyl)-2-pyrimidinyl]phenoxy}acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{4-[4-(4-Methylphenyl)-2-pyrimidinyl]phenoxy}acetonitrile has 0 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-[4-(4-Methylphenyl)-2-pyrimidinyl]phenoxy}acetonitrile?
The CAS number of 2-{4-[4-(4-Methylphenyl)-2-pyrimidinyl]phenoxy}acetonitrile is 477846-94-9.
What is the molecular formula of 2-{4-[4-(4-Methylphenyl)-2-pyrimidinyl]phenoxy}acetonitrile?
The molecular formula of 2-{4-[4-(4-Methylphenyl)-2-pyrimidinyl]phenoxy}acetonitrile is C19H15N3O.
What is the molecular weight of 2-{4-[4-(4-Methylphenyl)-2-pyrimidinyl]phenoxy}acetonitrile?
The molecular weight of 2-{4-[4-(4-Methylphenyl)-2-pyrimidinyl]phenoxy}acetonitrile is 301.12 g/mol.
Where can I buy 2-{4-[4-(4-Methylphenyl)-2-pyrimidinyl]phenoxy}acetonitrile?
You can request a quote for 2-{4-[4-(4-Methylphenyl)-2-pyrimidinyl]phenoxy}acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{4-[4-(4-Methylphenyl)-2-pyrimidinyl]phenoxy}acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-{4-[4-(4-Methylphenyl)-2-pyrimidinyl]phenoxy}acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.