(E)-5-(3-(3-ethoxy-4-hydroxyphenyl)acryloyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
TL;DR: (E)-5-(3-(3-ethoxy-4-hydroxyphenyl)acryloyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione (CAS 896856-71-6) is a chemical compound with molecular formula C17H18N2O6 and molecular weight 346.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(E)-3-(3-ethoxy-4-hydroxyphenyl)prop-2-enoyl]-6-hydroxy-1,3-dimethylpyrimidine-2,4-dione
Also Known As: (E)-5-(3-(3-ethoxy-4-hydroxyphenyl)acryloyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione, 5-[(2E)-3-(3-ethoxy-4-hydroxyphenyl)prop-2-enoyl]-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione, 5-[(E)-3-(3-ethoxy-4-hydroxyphenyl)prop-2-enoyl]-6-hydroxy-1,3-dimethylpyrimidine-2,4-dione
| Molecular Formula | C17H18N2O6 |
|---|---|
| Molecular Weight | 346.12 g/mol |
| LogP | 0.79 |
| Topological Polar Surface Area | 110.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 346.1165 |
| Heavy Atoms | 25 |
| Complexity | 968.3241 |
Chemical Identifiers
| CAS Number | 896856-71-6 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)/C=C/C(=O)C2=C(N(C(=O)N(C2=O)C)C)O)O |
Product Overview
(E)-5-(3-(3-ethoxy-4-hydroxyphenyl)acryloyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione (CAS 896856-71-6), with molecular formula C17H18N2O6 and molecular weight 346.12 g/mol. IUPAC: 5-[(E)-3-(3-ethoxy-4-hydroxyphenyl)prop-2-enoyl]-6-hydroxy-1,3-dimethylpyrimidine-2,4-dione.
Chemical Property Profile of (E)-5-(3-(3-ethoxy-4-hydroxyphenyl)acryloyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
Property Insights of (E)-5-(3-(3-ethoxy-4-hydroxyphenyl)acryloyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
The XLogP value of 0.79 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-5-(3-(3-ethoxy-4-hydroxyphenyl)acryloyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione. The TPSA of 110.76 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-5-(3-(3-ethoxy-4-hydroxyphenyl)acryloyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, (E)-5-(3-(3-ethoxy-4-hydroxyphenyl)acryloyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione has 2 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 (E)-5-(3-(3-ethoxy-4-hydroxyphenyl)acryloyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione?
The CAS number of (E)-5-(3-(3-ethoxy-4-hydroxyphenyl)acryloyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione is 896856-71-6.
What is the molecular formula of (E)-5-(3-(3-ethoxy-4-hydroxyphenyl)acryloyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione?
The molecular formula of (E)-5-(3-(3-ethoxy-4-hydroxyphenyl)acryloyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione is C17H18N2O6.
What is the molecular weight of (E)-5-(3-(3-ethoxy-4-hydroxyphenyl)acryloyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione?
The molecular weight of (E)-5-(3-(3-ethoxy-4-hydroxyphenyl)acryloyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione is 346.12 g/mol.
Where can I buy (E)-5-(3-(3-ethoxy-4-hydroxyphenyl)acryloyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione?
You can request a quote for (E)-5-(3-(3-ethoxy-4-hydroxyphenyl)acryloyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-5-(3-(3-ethoxy-4-hydroxyphenyl)acryloyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-(3-(3-ethoxy-4-hydroxyphenyl)acryloyl)-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.