Benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate
TL;DR: Benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate (CAS 13822-45-2) is a chemical compound with molecular formula C13H13NO5 and molecular weight 263.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate
Also Known As: Glu(OBzl)NCA, (GluObzl-NCA, Glu-(OBZL)-NCA, H-GLU(OBZL)-NCA, Benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate
| Molecular Formula | C13H13NO5 |
|---|---|
| Molecular Weight | 263.08 g/mol |
| LogP | 1.145 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 263.07938 |
| Heavy Atoms | 19 |
| Complexity | 485.06677 |
Chemical Identifiers
| CAS Number | 13822-45-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)CCC2C(=O)OC(=O)N2 |
Product Overview
Benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate (CAS 13822-45-2), with molecular formula C13H13NO5 and molecular weight 263.08 g/mol. IUPAC: benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate.
Chemical Property Profile of Benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate
Property Insights of Benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate
The XLogP value of 1.145 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate. Following Lipinski's Rule of Five, Benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate 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 Benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate?
The CAS number of Benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate is 13822-45-2.
What is the molecular formula of Benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate?
The molecular formula of Benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate is C13H13NO5.
What is the molecular weight of Benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate?
The molecular weight of Benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate is 263.08 g/mol.
Where can I buy Benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate?
You can request a quote for Benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.