![[2-Oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate structure](/static/products/3895/3895-16-7.webp)
[2-Oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate
TL;DR: [2-Oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate (CAS 3895-16-7) is a chemical compound with molecular formula C14H13N3O3 and molecular weight 271.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate
Also Known As: [2-oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate|2-Oxo-1-phenyl-2-[(pyrimidin-2-yl)amino]ethyl acetate|BENZENEACETAMIDE, A-(ACETYLOXY)-N-2-PYRIMIDINYL-
| Molecular Formula | C14H13N3O3 |
|---|---|
| Molecular Weight | 271.10 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 81.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 271.0957 |
| Heavy Atoms | 20 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 3895-16-7 |
|---|---|
| SMILES | CC(=O)OC(C1=CC=CC=C1)C(=O)NC2=NC=CC=N2 |
| InChIKey | NQSMSNUCLKQRIF-UHFFFAOYSA-N |
Product Overview
[2-Oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate (CAS 3895-16-7), with molecular formula C14H13N3O3 and molecular weight 271.10 g/mol. IUPAC: [2-oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate.
Chemical Property Profile of [2-Oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate
Property Insights of [2-Oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-Oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate. The TPSA of 81.2 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-Oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate. Following Lipinski's Rule of Five, [2-Oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate 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 [2-Oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate?
The CAS number of [2-Oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate is 3895-16-7.
What is the molecular formula of [2-Oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate?
The molecular formula of [2-Oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate is C14H13N3O3.
What is the molecular weight of [2-Oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate?
The molecular weight of [2-Oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate is 271.10 g/mol.
Where can I buy [2-Oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate?
You can request a quote for [2-Oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-Oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate?
Yes, KEHONG BIO provides custom synthesis services for [2-Oxo-1-phenyl-2-(pyrimidin-2-ylamino)ethyl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.