2-Methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole
TL;DR: 2-Methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole (CAS 102925-87-1) is a chemical compound with molecular formula C9H7N3O4 and molecular weight 221.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole
Also Known As: 2-Methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole, 1,3,4-Oxadiazole,2-methoxy-5-(4-nitrophenyl)-, 1,3,4-Oxadiazole,2-methoxy-5-(4-nitrophenyl)
| Molecular Formula | C9H7N3O4 |
|---|---|
| Molecular Weight | 221.04 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 94.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.04366 |
| Heavy Atoms | 16 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 102925-87-1 |
|---|---|
| SMILES | COC1=NN=C(O1)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | YKGDYDUGVHEJSG-UHFFFAOYSA-N |
Product Overview
2-Methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole (CAS 102925-87-1), with molecular formula C9H7N3O4 and molecular weight 221.04 g/mol. IUPAC: 2-methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole.
Chemical Property Profile of 2-Methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole
Property Insights of 2-Methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole. The TPSA of 94.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole. Following Lipinski's Rule of Five, 2-Methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole 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-Methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole?
The CAS number of 2-Methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole is 102925-87-1.
What is the molecular formula of 2-Methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole?
The molecular formula of 2-Methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole is C9H7N3O4.
What is the molecular weight of 2-Methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole?
The molecular weight of 2-Methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole is 221.04 g/mol.
Where can I buy 2-Methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole?
You can request a quote for 2-Methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxy-5-(4-nitrophenyl)-1,3,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.