![6-(2-{[(4-chlorobenzyl)oxy]imino}ethyl)-1-(3,4-dimethoxyphenethyl)-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile structure](/static/products/3031/303148-52-9.webp)
6-(2-{[(4-chlorobenzyl)oxy]imino}ethyl)-1-(3,4-dimethoxyphenethyl)-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile
TL;DR: 6-(2-{[(4-chlorobenzyl)oxy]imino}ethyl)-1-(3,4-dimethoxyphenethyl)-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile (CAS 303148-52-9) is a chemical compound with molecular formula C24H23ClN4O4 and molecular weight 466.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[2-[(4-chlorophenyl)methoxyimino]ethyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxopyrimidine-5-carbonitrile
Also Known As: 6-(2-{[(4-chlorobenzyl)oxy]imino}ethyl)-1-(3,4-dimethoxyphenethyl)-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile, 6-[2-[(4-chlorophenyl)methoxyimino]ethyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxopyrimidine-5-carbonitrile
| Molecular Formula | C24H23ClN4O4 |
|---|---|
| Molecular Weight | 466.14 g/mol |
| LogP | 3.77338 |
| Topological Polar Surface Area | 98.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 466.14078 |
| Heavy Atoms | 33 |
| Complexity | 1216.6144 |
Chemical Identifiers
| CAS Number | 303148-52-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCN2C=NC(=O)C(=C2CC=NOCC3=CC=C(C=C3)Cl)C#N)OC |
Product Overview
6-(2-{[(4-chlorobenzyl)oxy]imino}ethyl)-1-(3,4-dimethoxyphenethyl)-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile (CAS 303148-52-9), with molecular formula C24H23ClN4O4 and molecular weight 466.14 g/mol. IUPAC: 6-[2-[(4-chlorophenyl)methoxyimino]ethyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxopyrimidine-5-carbonitrile.
Chemical Property Profile of 6-(2-{[(4-chlorobenzyl)oxy]imino}ethyl)-1-(3,4-dimethoxyphenethyl)-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile
Property Insights of 6-(2-{[(4-chlorobenzyl)oxy]imino}ethyl)-1-(3,4-dimethoxyphenethyl)-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile
The XLogP value of 3.77338 indicates that 6-(2-{[(4-chlorobenzyl)oxy]imino}ethyl)-1-(3,4-dimethoxyphenethyl)-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(2-{[(4-chlorobenzyl)oxy]imino}ethyl)-1-(3,4-dimethoxyphenethyl)-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile. Following Lipinski's Rule of Five, 6-(2-{[(4-chlorobenzyl)oxy]imino}ethyl)-1-(3,4-dimethoxyphenethyl)-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile has 0 hydrogen bond donor(s) and 7 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 6-(2-{[(4-chlorobenzyl)oxy]imino}ethyl)-1-(3,4-dimethoxyphenethyl)-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile?
The CAS number of 6-(2-{[(4-chlorobenzyl)oxy]imino}ethyl)-1-(3,4-dimethoxyphenethyl)-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile is 303148-52-9.
What is the molecular formula of 6-(2-{[(4-chlorobenzyl)oxy]imino}ethyl)-1-(3,4-dimethoxyphenethyl)-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile?
The molecular formula of 6-(2-{[(4-chlorobenzyl)oxy]imino}ethyl)-1-(3,4-dimethoxyphenethyl)-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile is C24H23ClN4O4.
What is the molecular weight of 6-(2-{[(4-chlorobenzyl)oxy]imino}ethyl)-1-(3,4-dimethoxyphenethyl)-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile?
The molecular weight of 6-(2-{[(4-chlorobenzyl)oxy]imino}ethyl)-1-(3,4-dimethoxyphenethyl)-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile is 466.14 g/mol.
Where can I buy 6-(2-{[(4-chlorobenzyl)oxy]imino}ethyl)-1-(3,4-dimethoxyphenethyl)-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile?
You can request a quote for 6-(2-{[(4-chlorobenzyl)oxy]imino}ethyl)-1-(3,4-dimethoxyphenethyl)-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(2-{[(4-chlorobenzyl)oxy]imino}ethyl)-1-(3,4-dimethoxyphenethyl)-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-(2-{[(4-chlorobenzyl)oxy]imino}ethyl)-1-(3,4-dimethoxyphenethyl)-4-oxo-1,4-dihydro-5-pyrimidinecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.