![2-[5-(4-Nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol structure](/static/products/834/83431-80-5.png)
2-[5-(4-Nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol
TL;DR: 2-[5-(4-Nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol (CAS 83431-80-5) is a chemical compound with molecular formula C14H9N3O4 and molecular weight 283.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol
Also Known As: 2-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol, (6E)-6-[5-(4-nitrophenyl)-3H-1,3,4-oxadiazol-2-ylidene]cyclo, (6E)-6-[5-(4-Nitrophenyl)-1,3,4-oxadiazol-2(3H)-ylidene]cyclohexa-2,4-dien-1-one, (6E)-6-[5-(4-nitrophenyl)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one, (6Z)-6-[5-(4-nitrophenyl)-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,4-dien-1-one
| Molecular Formula | C14H9N3O4 |
|---|---|
| Molecular Weight | 283.06 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 283.0593 |
| Heavy Atoms | 21 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 83431-80-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2=NN=C(O2)C3=CC=C(C=C3)[N+](=O)[O-])O |
| InChIKey | SQYDLQWSDHXLIG-UHFFFAOYSA-N |
Product Overview
2-[5-(4-Nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol (CAS 83431-80-5), with molecular formula C14H9N3O4 and molecular weight 283.06 g/mol. IUPAC: 2-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol.
Chemical Property Profile of 2-[5-(4-Nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol
Property Insights of 2-[5-(4-Nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[5-(4-Nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[5-(4-Nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol. Following Lipinski's Rule of Five, 2-[5-(4-Nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol 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-[5-(4-Nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol?
The CAS number of 2-[5-(4-Nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol is 83431-80-5.
What is the molecular formula of 2-[5-(4-Nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol?
The molecular formula of 2-[5-(4-Nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol is C14H9N3O4.
What is the molecular weight of 2-[5-(4-Nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol?
The molecular weight of 2-[5-(4-Nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol is 283.06 g/mol.
Where can I buy 2-[5-(4-Nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol?
You can request a quote for 2-[5-(4-Nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[5-(4-Nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-[5-(4-Nitrophenyl)-1,3,4-oxadiazol-2-yl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.