Methyl 2-[(4-chloro-6-methoxy-2-pyrimidinyl)oxy]benzoate
TL;DR: Methyl 2-[(4-chloro-6-methoxy-2-pyrimidinyl)oxy]benzoate (CAS 110284-80-5) is a chemical compound with molecular formula C13H11ClN2O4 and molecular weight 294.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(4-chloro-6-methoxypyrimidin-2-yl)oxybenzoate
Also Known As: methyl 2-[(4-chloro-6-methoxy-2-pyrimidinyl)oxy]benzoate, AP-501/41252795, methyl 2-(4-chloro-6-methoxypyrimidin-2-yl)oxybenzoate, methyl 2-[(4-chloro-6-methoxypyrimidin-2-yl)oxy]benzoate, 2-[(4-Chloro-6-methoxypyrimidin-2-yl)oxy]benzoic acid methyl ester
| Molecular Formula | C13H11ClN2O4 |
|---|---|
| Molecular Weight | 294.04 g/mol |
| LogP | 2.7175 |
| Topological Polar Surface Area | 70.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 294.04074 |
| Heavy Atoms | 20 |
| Complexity | 633.51825 |
Chemical Identifiers
| CAS Number | 110284-80-5 |
|---|---|
| SMILES | COC1=CC(=NC(=N1)OC2=CC=CC=C2C(=O)OC)Cl |
Product Overview
Methyl 2-[(4-chloro-6-methoxy-2-pyrimidinyl)oxy]benzoate (CAS 110284-80-5), with molecular formula C13H11ClN2O4 and molecular weight 294.04 g/mol. IUPAC: methyl 2-(4-chloro-6-methoxypyrimidin-2-yl)oxybenzoate.
Chemical Property Profile of Methyl 2-[(4-chloro-6-methoxy-2-pyrimidinyl)oxy]benzoate
Property Insights of Methyl 2-[(4-chloro-6-methoxy-2-pyrimidinyl)oxy]benzoate
The XLogP value of 2.7175 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-[(4-chloro-6-methoxy-2-pyrimidinyl)oxy]benzoate. The TPSA of 70.54 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[(4-chloro-6-methoxy-2-pyrimidinyl)oxy]benzoate. Following Lipinski's Rule of Five, Methyl 2-[(4-chloro-6-methoxy-2-pyrimidinyl)oxy]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 Methyl 2-[(4-chloro-6-methoxy-2-pyrimidinyl)oxy]benzoate?
The CAS number of Methyl 2-[(4-chloro-6-methoxy-2-pyrimidinyl)oxy]benzoate is 110284-80-5.
What is the molecular formula of Methyl 2-[(4-chloro-6-methoxy-2-pyrimidinyl)oxy]benzoate?
The molecular formula of Methyl 2-[(4-chloro-6-methoxy-2-pyrimidinyl)oxy]benzoate is C13H11ClN2O4.
What is the molecular weight of Methyl 2-[(4-chloro-6-methoxy-2-pyrimidinyl)oxy]benzoate?
The molecular weight of Methyl 2-[(4-chloro-6-methoxy-2-pyrimidinyl)oxy]benzoate is 294.04 g/mol.
Where can I buy Methyl 2-[(4-chloro-6-methoxy-2-pyrimidinyl)oxy]benzoate?
You can request a quote for Methyl 2-[(4-chloro-6-methoxy-2-pyrimidinyl)oxy]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[(4-chloro-6-methoxy-2-pyrimidinyl)oxy]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[(4-chloro-6-methoxy-2-pyrimidinyl)oxy]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.