2-p-Nitrophenyl-5-isopropyloxy-oxadiazole-1,3,4
TL;DR: 2-p-Nitrophenyl-5-isopropyloxy-oxadiazole-1,3,4 (CAS 41125-94-4) is a chemical compound with molecular formula C11H11N3O4 and molecular weight 249.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-nitrophenyl)-5-propan-2-yloxy-1,3,4-oxadiazole
Also Known As: 2-p-Nitrophenyl-5-isopropyloxy-oxadiazole-1,3,4, 2-isopropoxy-5-(4-nitro-phenyl)-[1,3,4]oxadiazole, 2-Isopropoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole #, 2-(4-nitrophenyl)-5-propan-2-yloxy-1,3,4-oxadiazole
| Molecular Formula | C11H11N3O4 |
|---|---|
| Molecular Weight | 249.07 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 94.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.07495 |
| Heavy Atoms | 18 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 41125-94-4 |
|---|---|
| SMILES | CC(C)OC1=NN=C(O1)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | ARYMESZKHKHRFT-UHFFFAOYSA-N |
Product Overview
2-p-Nitrophenyl-5-isopropyloxy-oxadiazole-1,3,4 (CAS 41125-94-4), with molecular formula C11H11N3O4 and molecular weight 249.07 g/mol. IUPAC: 2-(4-nitrophenyl)-5-propan-2-yloxy-1,3,4-oxadiazole.
Chemical Property Profile of 2-p-Nitrophenyl-5-isopropyloxy-oxadiazole-1,3,4
Property Insights of 2-p-Nitrophenyl-5-isopropyloxy-oxadiazole-1,3,4
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-p-Nitrophenyl-5-isopropyloxy-oxadiazole-1,3,4. The TPSA of 94.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-p-Nitrophenyl-5-isopropyloxy-oxadiazole-1,3,4. Following Lipinski's Rule of Five, 2-p-Nitrophenyl-5-isopropyloxy-oxadiazole-1,3,4 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-p-Nitrophenyl-5-isopropyloxy-oxadiazole-1,3,4?
The CAS number of 2-p-Nitrophenyl-5-isopropyloxy-oxadiazole-1,3,4 is 41125-94-4.
What is the molecular formula of 2-p-Nitrophenyl-5-isopropyloxy-oxadiazole-1,3,4?
The molecular formula of 2-p-Nitrophenyl-5-isopropyloxy-oxadiazole-1,3,4 is C11H11N3O4.
What is the molecular weight of 2-p-Nitrophenyl-5-isopropyloxy-oxadiazole-1,3,4?
The molecular weight of 2-p-Nitrophenyl-5-isopropyloxy-oxadiazole-1,3,4 is 249.07 g/mol.
Where can I buy 2-p-Nitrophenyl-5-isopropyloxy-oxadiazole-1,3,4?
You can request a quote for 2-p-Nitrophenyl-5-isopropyloxy-oxadiazole-1,3,4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-p-Nitrophenyl-5-isopropyloxy-oxadiazole-1,3,4?
Yes, KEHONG BIO provides custom synthesis services for 2-p-Nitrophenyl-5-isopropyloxy-oxadiazole-1,3,4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.