3-(5-Amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl acetate
TL;DR: 3-(5-Amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl acetate (CAS 871547-77-2) is a chemical compound with molecular formula C12H11N3O4 and molecular weight 261.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(5-amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl] acetate
Also Known As: 3-(5-amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl acetate, 3-(5-amino-4-carbamoyloxazol-2-yl)phenyl acetate, 3-(5-amino-4-carbamoyl-1,3-oxazol-2-yl)phenylacetate, [3-(5-amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl] acetate
| Molecular Formula | C12H11N3O4 |
|---|---|
| Molecular Weight | 261.07 g/mol |
| LogP | 0.948 |
| Topological Polar Surface Area | 121.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 261.07495 |
| Heavy Atoms | 19 |
| Complexity | 648.1741 |
Chemical Identifiers
| CAS Number | 871547-77-2 |
|---|---|
| SMILES | CC(=O)OC1=CC=CC(=C1)C2=NC(=C(O2)N)C(=O)N |
Product Overview
3-(5-Amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl acetate (CAS 871547-77-2), with molecular formula C12H11N3O4 and molecular weight 261.07 g/mol. IUPAC: [3-(5-amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl] acetate.
Chemical Property Profile of 3-(5-Amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl acetate
Property Insights of 3-(5-Amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl acetate
The XLogP value of 0.948 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-Amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl acetate. The TPSA of 121.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(5-Amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl acetate. Following Lipinski's Rule of Five, 3-(5-Amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl acetate 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 3-(5-Amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl acetate?
The CAS number of 3-(5-Amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl acetate is 871547-77-2.
What is the molecular formula of 3-(5-Amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl acetate?
The molecular formula of 3-(5-Amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl acetate is C12H11N3O4.
What is the molecular weight of 3-(5-Amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl acetate?
The molecular weight of 3-(5-Amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl acetate is 261.07 g/mol.
Where can I buy 3-(5-Amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl acetate?
You can request a quote for 3-(5-Amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5-Amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-Amino-4-carbamoyl-1,3-oxazol-2-yl)phenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.