1-(4-nitrophenyl)-5-phenyl-1H-tetrazole
TL;DR: 1-(4-nitrophenyl)-5-phenyl-1H-tetrazole (CAS 57761-71-4) is a chemical compound with molecular formula C13H9N5O2 and molecular weight 267.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-nitrophenyl)-5-phenyltetrazole
Also Known As: 1-(4-nitrophenyl)-5-phenyl-1H-tetrazole, 1-(4-nitrophenyl)-5-phenyltetrazole, 1H-Tetrazole, 1-(4-nitrophenyl)-5-phenyl-, 1-(4-nitrophenyl)-5-phenyl-1,2,3,4-tetraazole
| Molecular Formula | C13H9N5O2 |
|---|---|
| Molecular Weight | 267.08 g/mol |
| LogP | 2.2375 |
| Topological Polar Surface Area | 86.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.07562 |
| Heavy Atoms | 20 |
| Complexity | 736.9678 |
Chemical Identifiers
| CAS Number | 57761-71-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NN=NN2C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
1-(4-nitrophenyl)-5-phenyl-1H-tetrazole (CAS 57761-71-4), with molecular formula C13H9N5O2 and molecular weight 267.08 g/mol. IUPAC: 1-(4-nitrophenyl)-5-phenyltetrazole.
Chemical Property Profile of 1-(4-nitrophenyl)-5-phenyl-1H-tetrazole
Property Insights of 1-(4-nitrophenyl)-5-phenyl-1H-tetrazole
The XLogP value of 2.2375 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-nitrophenyl)-5-phenyl-1H-tetrazole. The TPSA of 86.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-nitrophenyl)-5-phenyl-1H-tetrazole. Following Lipinski's Rule of Five, 1-(4-nitrophenyl)-5-phenyl-1H-tetrazole has 0 hydrogen bond donor(s) and 5 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 1-(4-nitrophenyl)-5-phenyl-1H-tetrazole?
The CAS number of 1-(4-nitrophenyl)-5-phenyl-1H-tetrazole is 57761-71-4.
What is the molecular formula of 1-(4-nitrophenyl)-5-phenyl-1H-tetrazole?
The molecular formula of 1-(4-nitrophenyl)-5-phenyl-1H-tetrazole is C13H9N5O2.
What is the molecular weight of 1-(4-nitrophenyl)-5-phenyl-1H-tetrazole?
The molecular weight of 1-(4-nitrophenyl)-5-phenyl-1H-tetrazole is 267.08 g/mol.
Where can I buy 1-(4-nitrophenyl)-5-phenyl-1H-tetrazole?
You can request a quote for 1-(4-nitrophenyl)-5-phenyl-1H-tetrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-nitrophenyl)-5-phenyl-1H-tetrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-nitrophenyl)-5-phenyl-1H-tetrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.