RefChem:304744
TL;DR: RefChem:304744 (CAS 64678-08-6) is a chemical compound with molecular formula C20H25ClN2O3 and molecular weight 376.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-[(4-butoxyphenyl)methyl]-4-chloro-6-methylpyrimidin-5-yl]acetate
Also Known As: 1,3-Dioxepane,5,6-dibromo-2-propyl, 5-Pyrimidineacetic acid, 2-((4-butoxyphenyl)methyl)-4-chloro-6-methyl-, ethyl ester, 2-((4-Butoxyphenyl)methyl)-4-chloro-6-methy-5-pyrimidineacetic acid ethyl ester, 2-( -4-chloro-6-methy-5-pyrimidineaceticacidethylester, ethyl 2-[2-[(4-butoxyphenyl)methyl]-4-chloro-6-methylpyrimidin-5-yl]acetate
| Molecular Formula | C20H25ClN2O3 |
|---|---|
| Molecular Weight | 376.16 g/mol |
| LogP | 4.31372 |
| Topological Polar Surface Area | 61.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 376.15536 |
| Heavy Atoms | 26 |
| Complexity | 709.3313 |
Chemical Identifiers
| CAS Number | 64678-08-6 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)CC2=NC(=C(C(=N2)Cl)CC(=O)OCC)C |
Product Overview
RefChem:304744 (CAS 64678-08-6), with molecular formula C20H25ClN2O3 and molecular weight 376.16 g/mol. IUPAC: ethyl 2-[2-[(4-butoxyphenyl)methyl]-4-chloro-6-methylpyrimidin-5-yl]acetate.
Chemical Property Profile of RefChem:304744
Property Insights of RefChem:304744
The XLogP value of 4.31372 indicates that RefChem:304744 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.31 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:304744. Following Lipinski's Rule of Five, RefChem:304744 has 0 hydrogen bond donor(s) and 5 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 RefChem:304744?
The CAS number of RefChem:304744 is 64678-08-6.
What is the molecular formula of RefChem:304744?
The molecular formula of RefChem:304744 is C20H25ClN2O3.
What is the molecular weight of RefChem:304744?
The molecular weight of RefChem:304744 is 376.16 g/mol.
Where can I buy RefChem:304744?
You can request a quote for RefChem:304744 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:304744?
Yes, KEHONG BIO provides custom synthesis services for RefChem:304744 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.