2-(5-Methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione
TL;DR: 2-(5-Methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione (CAS 330466-18-7) is a chemical compound with molecular formula C12H7N3O5 and molecular weight 273.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione
Also Known As: 2-(5-methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione, 2-(5-methylisoxazol-3-yl)-4-nitrobenzo[c]azoline-1,3-dione, 2-(5-methyl-1,2-oxazol-3-yl)-4-nitro-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C12H7N3O5 |
|---|---|
| Molecular Weight | 273.04 g/mol |
| LogP | 1.69182 |
| Topological Polar Surface Area | 106.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.03857 |
| Heavy Atoms | 20 |
| Complexity | 764.2033 |
Chemical Identifiers
| CAS Number | 330466-18-7 |
|---|---|
| SMILES | CC1=CC(=NO1)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-] |
Product Overview
2-(5-Methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione (CAS 330466-18-7), with molecular formula C12H7N3O5 and molecular weight 273.04 g/mol. IUPAC: 2-(5-methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione.
Chemical Property Profile of 2-(5-Methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione
Property Insights of 2-(5-Methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione
The XLogP value of 1.69182 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(5-Methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione. The TPSA of 106.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(5-Methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione. Following Lipinski's Rule of Five, 2-(5-Methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione has 0 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-(5-Methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione?
The CAS number of 2-(5-Methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione is 330466-18-7.
What is the molecular formula of 2-(5-Methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione?
The molecular formula of 2-(5-Methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione is C12H7N3O5.
What is the molecular weight of 2-(5-Methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione?
The molecular weight of 2-(5-Methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione is 273.04 g/mol.
Where can I buy 2-(5-Methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione?
You can request a quote for 2-(5-Methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-Methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-Methyl-1,2-oxazol-3-yl)-4-nitroisoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.