(E)-N-(2-(((1-(3,4-dimethoxyphenethyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)phenyl)acetamide
TL;DR: (E)-N-(2-(((1-(3,4-dimethoxyphenethyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)phenyl)acetamide (CAS 713092-76-3) is a chemical compound with molecular formula C23H24N4O6 and molecular weight 452.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[[1-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-2,4-dioxopyrimidin-5-yl]methylideneamino]phenyl]acetamide
Also Known As: (E)-N-(2-(((1-(3,4-dimethoxyphenethyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)phenyl)acetamide, N-(2-{[(Z)-{1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene}methyl]amino}phenyl)acetamide, N-[2-[[(E)-[1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]amino]phenyl]acetamide, N-[2-[[(Z)-[1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl]amino]phenyl]acetamide, N-[2-[[1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4,6-trioxo-1,3-diazinan-5-ylidene]methylamino]phenyl]acetamide
| Molecular Formula | C23H24N4O6 |
|---|---|
| Molecular Weight | 452.17 g/mol |
| LogP | 2.2111 |
| Topological Polar Surface Area | 135.01 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 452.1696 |
| Heavy Atoms | 33 |
| Complexity | 1309.0343 |
Chemical Identifiers
| CAS Number | 713092-76-3 |
|---|---|
| SMILES | CC(=O)NC1=CC=CC=C1N=CC2=C(N(C(=O)NC2=O)CCC3=CC(=C(C=C3)OC)OC)O |
Product Overview
(E)-N-(2-(((1-(3,4-dimethoxyphenethyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)phenyl)acetamide (CAS 713092-76-3), with molecular formula C23H24N4O6 and molecular weight 452.17 g/mol. IUPAC: N-[2-[[1-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-2,4-dioxopyrimidin-5-yl]methylideneamino]phenyl]acetamide.
Chemical Property Profile of (E)-N-(2-(((1-(3,4-dimethoxyphenethyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)phenyl)acetamide
Property Insights of (E)-N-(2-(((1-(3,4-dimethoxyphenethyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)phenyl)acetamide
The XLogP value of 2.2111 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N-(2-(((1-(3,4-dimethoxyphenethyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)phenyl)acetamide. The TPSA of 135.01 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-(2-(((1-(3,4-dimethoxyphenethyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)phenyl)acetamide. Following Lipinski's Rule of Five, (E)-N-(2-(((1-(3,4-dimethoxyphenethyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)phenyl)acetamide has 3 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 (E)-N-(2-(((1-(3,4-dimethoxyphenethyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)phenyl)acetamide?
The CAS number of (E)-N-(2-(((1-(3,4-dimethoxyphenethyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)phenyl)acetamide is 713092-76-3.
What is the molecular formula of (E)-N-(2-(((1-(3,4-dimethoxyphenethyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)phenyl)acetamide?
The molecular formula of (E)-N-(2-(((1-(3,4-dimethoxyphenethyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)phenyl)acetamide is C23H24N4O6.
What is the molecular weight of (E)-N-(2-(((1-(3,4-dimethoxyphenethyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)phenyl)acetamide?
The molecular weight of (E)-N-(2-(((1-(3,4-dimethoxyphenethyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)phenyl)acetamide is 452.17 g/mol.
Where can I buy (E)-N-(2-(((1-(3,4-dimethoxyphenethyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)phenyl)acetamide?
You can request a quote for (E)-N-(2-(((1-(3,4-dimethoxyphenethyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)phenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-(2-(((1-(3,4-dimethoxyphenethyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)phenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-(2-(((1-(3,4-dimethoxyphenethyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)phenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.