![1H-Tetrazole, 5-[[(3,5-dinitrophenyl)methyl]thio]-1-phenyl- structure](/static/products/816/81645-87-6.png)
1H-Tetrazole, 5-[[(3,5-dinitrophenyl)methyl]thio]-1-phenyl-
TL;DR: 1H-Tetrazole, 5-[[(3,5-dinitrophenyl)methyl]thio]-1-phenyl- (CAS 81645-87-6) is a chemical compound with molecular formula C14H10N6O4S and molecular weight 358.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3,5-dinitrophenyl)methylsulfanyl]-1-phenyltetrazole
Also Known As: 1H-Tetrazole, 5-(((3,5-dinitrophenyl)methyl)thio)-1-phenyl-, 1H-Tetrazole, 5-[[(3,5-dinitrophenyl)methyl]thio]-1-phenyl-, 5-[(3,5-dinitrophenyl)methylsulfanyl]-1-phenyltetrazole, 5-[(3,5-dinitrophenyl)methylsulfanyl]-1-phenyl-tetrazole, 5-[[(3,5-Dinitrophenyl)methyl]thio]-1-phenyl-1H-tetrazole
| Molecular Formula | C14H10N6O4S |
|---|---|
| Molecular Weight | 358.05 g/mol |
| LogP | 2.771 |
| Topological Polar Surface Area | 129.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 358.04843 |
| Heavy Atoms | 25 |
| Complexity | 897.83124 |
Chemical Identifiers
| CAS Number | 81645-87-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=N2)SCC3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
1H-Tetrazole, 5-[[(3,5-dinitrophenyl)methyl]thio]-1-phenyl- (CAS 81645-87-6), with molecular formula C14H10N6O4S and molecular weight 358.05 g/mol. IUPAC: 5-[(3,5-dinitrophenyl)methylsulfanyl]-1-phenyltetrazole.
Chemical Property Profile of 1H-Tetrazole, 5-[[(3,5-dinitrophenyl)methyl]thio]-1-phenyl-
Property Insights of 1H-Tetrazole, 5-[[(3,5-dinitrophenyl)methyl]thio]-1-phenyl-
The XLogP value of 2.771 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Tetrazole, 5-[[(3,5-dinitrophenyl)methyl]thio]-1-phenyl-. The TPSA of 129.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Tetrazole, 5-[[(3,5-dinitrophenyl)methyl]thio]-1-phenyl-. Following Lipinski's Rule of Five, 1H-Tetrazole, 5-[[(3,5-dinitrophenyl)methyl]thio]-1-phenyl- has 0 hydrogen bond donor(s) and 8 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 1H-Tetrazole, 5-[[(3,5-dinitrophenyl)methyl]thio]-1-phenyl-?
The CAS number of 1H-Tetrazole, 5-[[(3,5-dinitrophenyl)methyl]thio]-1-phenyl- is 81645-87-6.
What is the molecular formula of 1H-Tetrazole, 5-[[(3,5-dinitrophenyl)methyl]thio]-1-phenyl-?
The molecular formula of 1H-Tetrazole, 5-[[(3,5-dinitrophenyl)methyl]thio]-1-phenyl- is C14H10N6O4S.
What is the molecular weight of 1H-Tetrazole, 5-[[(3,5-dinitrophenyl)methyl]thio]-1-phenyl-?
The molecular weight of 1H-Tetrazole, 5-[[(3,5-dinitrophenyl)methyl]thio]-1-phenyl- is 358.05 g/mol.
Where can I buy 1H-Tetrazole, 5-[[(3,5-dinitrophenyl)methyl]thio]-1-phenyl-?
You can request a quote for 1H-Tetrazole, 5-[[(3,5-dinitrophenyl)methyl]thio]-1-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Tetrazole, 5-[[(3,5-dinitrophenyl)methyl]thio]-1-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Tetrazole, 5-[[(3,5-dinitrophenyl)methyl]thio]-1-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.