Phenol, 4-(4-(dimethoxymethyl)-2-pyrimidinyl)-, 1-benzoate
TL;DR: Phenol, 4-(4-(dimethoxymethyl)-2-pyrimidinyl)-, 1-benzoate (CAS 477870-43-2) is a chemical compound with molecular formula C20H18N2O4 and molecular weight 350.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[4-(dimethoxymethyl)pyrimidin-2-yl]phenyl] benzoate
Also Known As: Bionet1_004002, DivK1c_002498, 4-[4-(dimethoxymethyl)-2-pyrimidinyl]phenyl benzenecarboxylate, CDS1_001458, 4-[4-(dimethoxymethyl)pyrimidin-2-yl]phenyl benzoate
| Molecular Formula | C20H18N2O4 |
|---|---|
| Molecular Weight | 350.13 g/mol |
| LogP | 3.6542 |
| Topological Polar Surface Area | 70.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 350.12665 |
| Heavy Atoms | 26 |
| Complexity | 862.4944 |
Chemical Identifiers
| CAS Number | 477870-43-2 |
|---|---|
| SMILES | COC(C1=NC(=NC=C1)C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3)OC |
Product Overview
Phenol, 4-(4-(dimethoxymethyl)-2-pyrimidinyl)-, 1-benzoate (CAS 477870-43-2), with molecular formula C20H18N2O4 and molecular weight 350.13 g/mol. IUPAC: [4-[4-(dimethoxymethyl)pyrimidin-2-yl]phenyl] benzoate.
Chemical Property Profile of Phenol, 4-(4-(dimethoxymethyl)-2-pyrimidinyl)-, 1-benzoate
Property Insights of Phenol, 4-(4-(dimethoxymethyl)-2-pyrimidinyl)-, 1-benzoate
The XLogP value of 3.6542 indicates that Phenol, 4-(4-(dimethoxymethyl)-2-pyrimidinyl)-, 1-benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.54 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenol, 4-(4-(dimethoxymethyl)-2-pyrimidinyl)-, 1-benzoate. Following Lipinski's Rule of Five, Phenol, 4-(4-(dimethoxymethyl)-2-pyrimidinyl)-, 1-benzoate has 0 hydrogen bond donor(s) and 6 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 Phenol, 4-(4-(dimethoxymethyl)-2-pyrimidinyl)-, 1-benzoate?
The CAS number of Phenol, 4-(4-(dimethoxymethyl)-2-pyrimidinyl)-, 1-benzoate is 477870-43-2.
What is the molecular formula of Phenol, 4-(4-(dimethoxymethyl)-2-pyrimidinyl)-, 1-benzoate?
The molecular formula of Phenol, 4-(4-(dimethoxymethyl)-2-pyrimidinyl)-, 1-benzoate is C20H18N2O4.
What is the molecular weight of Phenol, 4-(4-(dimethoxymethyl)-2-pyrimidinyl)-, 1-benzoate?
The molecular weight of Phenol, 4-(4-(dimethoxymethyl)-2-pyrimidinyl)-, 1-benzoate is 350.13 g/mol.
Where can I buy Phenol, 4-(4-(dimethoxymethyl)-2-pyrimidinyl)-, 1-benzoate?
You can request a quote for Phenol, 4-(4-(dimethoxymethyl)-2-pyrimidinyl)-, 1-benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 4-(4-(dimethoxymethyl)-2-pyrimidinyl)-, 1-benzoate?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 4-(4-(dimethoxymethyl)-2-pyrimidinyl)-, 1-benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.