2-(1,3-Benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine
TL;DR: 2-(1,3-Benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine (CAS 313670-82-5) is a chemical compound with molecular formula C16H14N2O5 and molecular weight 314.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine
Also Known As: BAS 00655056, 2-(1,3-benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine, AB00087243-01, 2-Benzo[1,3]dioxol-5-yl-5-(4-nitro-phenyl)-oxazolidine, 2-(benzo[d][1,3]dioxol-5-yl)-5-(4-nitrophenyl)oxazolidine
| Molecular Formula | C16H14N2O5 |
|---|---|
| Molecular Weight | 314.09 g/mol |
| LogP | 2.6832 |
| Topological Polar Surface Area | 82.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 314.09027 |
| Heavy Atoms | 23 |
| Complexity | 746.63586 |
Chemical Identifiers
| CAS Number | 313670-82-5 |
|---|---|
| SMILES | C1C(OC(N1)C2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
2-(1,3-Benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine (CAS 313670-82-5), with molecular formula C16H14N2O5 and molecular weight 314.09 g/mol. IUPAC: 2-(1,3-benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine.
Chemical Property Profile of 2-(1,3-Benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine
Property Insights of 2-(1,3-Benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine
The XLogP value of 2.6832 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,3-Benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine. The TPSA of 82.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,3-Benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine. Following Lipinski's Rule of Five, 2-(1,3-Benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine has 1 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 2-(1,3-Benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine?
The CAS number of 2-(1,3-Benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine is 313670-82-5.
What is the molecular formula of 2-(1,3-Benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine?
The molecular formula of 2-(1,3-Benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine is C16H14N2O5.
What is the molecular weight of 2-(1,3-Benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine?
The molecular weight of 2-(1,3-Benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine is 314.09 g/mol.
Where can I buy 2-(1,3-Benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine?
You can request a quote for 2-(1,3-Benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-Benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-Benzodioxol-5-yl)-5-(4-nitrophenyl)-1,3-oxazolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.