![Ethyl 3-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxopropanoate structure](/static/products/866/866153-79-9.png)
Ethyl 3-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxopropanoate
TL;DR: Ethyl 3-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxopropanoate (CAS 866153-79-9) is a chemical compound with molecular formula C11H15N3O3 and molecular weight 237.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[(4,6-dimethylpyrimidin-2-yl)amino]-3-oxopropanoate
Also Known As: ethyl 3-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxopropanoate, ethyl 2-[(4,6-dimethylpyrimidin-2-yl)carbamoyl]acetate, ethyl 3-[(4,6-dimethylpyrimidin-2-yl)amino]-3-oxopropanoate, ethyl2-[(4,6-dimethylpyrimidin-2-yl)carbamoyl]acetate, ethyl 3-[(4,6-dimethylpyrimidin-2-yl)amino]-3-oxo-propanoate
| Molecular Formula | C11H15N3O3 |
|---|---|
| Molecular Weight | 237.11 g/mol |
| LogP | 0.98514 |
| Topological Polar Surface Area | 81.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 237.11134 |
| Heavy Atoms | 17 |
| Complexity | 411.71988 |
Chemical Identifiers
| CAS Number | 866153-79-9 |
|---|---|
| SMILES | CCOC(=O)CC(=O)NC1=NC(=CC(=N1)C)C |
Product Overview
Ethyl 3-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxopropanoate (CAS 866153-79-9), with molecular formula C11H15N3O3 and molecular weight 237.11 g/mol. IUPAC: ethyl 3-[(4,6-dimethylpyrimidin-2-yl)amino]-3-oxopropanoate.
Chemical Property Profile of Ethyl 3-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxopropanoate
Property Insights of Ethyl 3-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxopropanoate
The XLogP value of 0.98514 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxopropanoate. The TPSA of 81.18 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxopropanoate. Following Lipinski's Rule of Five, Ethyl 3-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxopropanoate has 1 hydrogen bond donor(s) and 5 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 3-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxopropanoate?
The CAS number of Ethyl 3-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxopropanoate is 866153-79-9.
What is the molecular formula of Ethyl 3-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxopropanoate?
The molecular formula of Ethyl 3-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxopropanoate is C11H15N3O3.
What is the molecular weight of Ethyl 3-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxopropanoate?
The molecular weight of Ethyl 3-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxopropanoate is 237.11 g/mol.
Where can I buy Ethyl 3-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxopropanoate?
You can request a quote for Ethyl 3-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxopropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxopropanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-oxopropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.