Ethyl 2-(3,5-dichloro-4-oxo-1,4-dihydropyridin-1-yl)acetate
TL;DR: Ethyl 2-(3,5-dichloro-4-oxo-1,4-dihydropyridin-1-yl)acetate (CAS 70149-51-8) is a chemical compound with molecular formula C9H9Cl2NO3 and molecular weight 249.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(3,5-dichloro-4-oxo-1-pyridinyl)acetate
Also Known As: ETHYL2- ACETATE, Maybridge1_005894, ethyl 2-(3,5-dichloro-4-oxo-1,4-dihydropyridin-1-yl)acetate, ethyl 2-(3,5-dichloro-4-oxopyridin-1-yl)acetate, 1(4H)-Pyridineaceticacid, 3,5-dichloro-4-oxo-, ethyl ester
| Molecular Formula | C9H9Cl2NO3 |
|---|---|
| Molecular Weight | 249.00 g/mol |
| LogP | 1.7182 |
| Topological Polar Surface Area | 48.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.99594 |
| Heavy Atoms | 15 |
| Complexity | 401.6059 |
Chemical Identifiers
| CAS Number | 70149-51-8 |
|---|---|
| SMILES | CCOC(=O)CN1C=C(C(=O)C(=C1)Cl)Cl |
Product Overview
Ethyl 2-(3,5-dichloro-4-oxo-1,4-dihydropyridin-1-yl)acetate (CAS 70149-51-8), with molecular formula C9H9Cl2NO3 and molecular weight 249.00 g/mol. IUPAC: ethyl 2-(3,5-dichloro-4-oxo-1-pyridinyl)acetate.
Chemical Property Profile of Ethyl 2-(3,5-dichloro-4-oxo-1,4-dihydropyridin-1-yl)acetate
Property Insights of Ethyl 2-(3,5-dichloro-4-oxo-1,4-dihydropyridin-1-yl)acetate
The XLogP value of 1.7182 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(3,5-dichloro-4-oxo-1,4-dihydropyridin-1-yl)acetate. With a topological polar surface area (TPSA) of 48.3 Ų, Ethyl 2-(3,5-dichloro-4-oxo-1,4-dihydropyridin-1-yl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-(3,5-dichloro-4-oxo-1,4-dihydropyridin-1-yl)acetate has 0 hydrogen bond donor(s) and 3 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 Ethyl 2-(3,5-dichloro-4-oxo-1,4-dihydropyridin-1-yl)acetate?
The CAS number of Ethyl 2-(3,5-dichloro-4-oxo-1,4-dihydropyridin-1-yl)acetate is 70149-51-8.
What is the molecular formula of Ethyl 2-(3,5-dichloro-4-oxo-1,4-dihydropyridin-1-yl)acetate?
The molecular formula of Ethyl 2-(3,5-dichloro-4-oxo-1,4-dihydropyridin-1-yl)acetate is C9H9Cl2NO3.
What is the molecular weight of Ethyl 2-(3,5-dichloro-4-oxo-1,4-dihydropyridin-1-yl)acetate?
The molecular weight of Ethyl 2-(3,5-dichloro-4-oxo-1,4-dihydropyridin-1-yl)acetate is 249.00 g/mol.
Where can I buy Ethyl 2-(3,5-dichloro-4-oxo-1,4-dihydropyridin-1-yl)acetate?
You can request a quote for Ethyl 2-(3,5-dichloro-4-oxo-1,4-dihydropyridin-1-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(3,5-dichloro-4-oxo-1,4-dihydropyridin-1-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(3,5-dichloro-4-oxo-1,4-dihydropyridin-1-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.