2-(3-((2,5-Dimethoxyphenyl)amino)acryloyl)cyclohexane-1,3-dione
TL;DR: 2-(3-((2,5-Dimethoxyphenyl)amino)acryloyl)cyclohexane-1,3-dione (CAS 382617-64-3) is a chemical compound with molecular formula C17H19NO5 and molecular weight 317.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(2,5-dimethoxyanilino)prop-2-enoyl]cyclohexane-1,3-dione
Also Known As: 2-(3-((2,5-dimethoxyphenyl)amino)acryloyl)cyclohexane-1,3-dione, 2-[3-(2,5-dimethoxyanilino)prop-2-enoyl]cyclohexane-1,3-dione, 2-[3-[(2,5-dimethoxyphenyl)amino]prop-2-enoyl]cyclohexane-1,3-dione
| Molecular Formula | C17H19NO5 |
|---|---|
| Molecular Weight | 317.13 g/mol |
| LogP | 2.1368 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 317.1263 |
| Heavy Atoms | 23 |
| Complexity | 634.38385 |
Chemical Identifiers
| CAS Number | 382617-64-3 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)OC)NC=CC(=O)C2C(=O)CCCC2=O |
Product Overview
2-(3-((2,5-Dimethoxyphenyl)amino)acryloyl)cyclohexane-1,3-dione (CAS 382617-64-3), with molecular formula C17H19NO5 and molecular weight 317.13 g/mol. IUPAC: 2-[3-(2,5-dimethoxyanilino)prop-2-enoyl]cyclohexane-1,3-dione.
Chemical Property Profile of 2-(3-((2,5-Dimethoxyphenyl)amino)acryloyl)cyclohexane-1,3-dione
Property Insights of 2-(3-((2,5-Dimethoxyphenyl)amino)acryloyl)cyclohexane-1,3-dione
The XLogP value of 2.1368 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-((2,5-Dimethoxyphenyl)amino)acryloyl)cyclohexane-1,3-dione. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-((2,5-Dimethoxyphenyl)amino)acryloyl)cyclohexane-1,3-dione. Following Lipinski's Rule of Five, 2-(3-((2,5-Dimethoxyphenyl)amino)acryloyl)cyclohexane-1,3-dione has 1 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 2-(3-((2,5-Dimethoxyphenyl)amino)acryloyl)cyclohexane-1,3-dione?
The CAS number of 2-(3-((2,5-Dimethoxyphenyl)amino)acryloyl)cyclohexane-1,3-dione is 382617-64-3.
What is the molecular formula of 2-(3-((2,5-Dimethoxyphenyl)amino)acryloyl)cyclohexane-1,3-dione?
The molecular formula of 2-(3-((2,5-Dimethoxyphenyl)amino)acryloyl)cyclohexane-1,3-dione is C17H19NO5.
What is the molecular weight of 2-(3-((2,5-Dimethoxyphenyl)amino)acryloyl)cyclohexane-1,3-dione?
The molecular weight of 2-(3-((2,5-Dimethoxyphenyl)amino)acryloyl)cyclohexane-1,3-dione is 317.13 g/mol.
Where can I buy 2-(3-((2,5-Dimethoxyphenyl)amino)acryloyl)cyclohexane-1,3-dione?
You can request a quote for 2-(3-((2,5-Dimethoxyphenyl)amino)acryloyl)cyclohexane-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-((2,5-Dimethoxyphenyl)amino)acryloyl)cyclohexane-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-((2,5-Dimethoxyphenyl)amino)acryloyl)cyclohexane-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.