![N~1~-{(1E)-[4-(methylthio)phenyl]methylene}-1H-tetrazole-1,5-diamine structure](/static/products/584/5848-48-6.png)
N~1~-{(1E)-[4-(methylthio)phenyl]methylene}-1H-tetrazole-1,5-diamine
TL;DR: N~1~-{(1E)-[4-(methylthio)phenyl]methylene}-1H-tetrazole-1,5-diamine (CAS 5848-48-6) is a chemical compound with molecular formula C9H10N6S and molecular weight 234.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-(4-methylsulfanylphenyl)methylideneamino]tetrazol-5-amine
Also Known As: 1-[(E)-(4-methylsulfanylphenyl)methylideneamino]tetrazol-5-amine, N~1~-{(1E)-[4-(methylthio)phenyl]methylene}-1H-tetrazole-1,5-diamine, [1-[[4-(methylthio)benzylidene]amino]tetrazol-5-yl]amine, 1-[[4-(methylthio)phenyl]methylideneamino]-5-tetrazolamine, A1901/0079818
| Molecular Formula | C9H10N6S |
|---|---|
| Molecular Weight | 234.07 g/mol |
| LogP | 0.8594 |
| Topological Polar Surface Area | 81.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.06877 |
| Heavy Atoms | 16 |
| Complexity | 488.95526 |
Chemical Identifiers
| CAS Number | 5848-48-6 |
|---|---|
| SMILES | CSC1=CC=C(C=C1)/C=N/N2C(=NN=N2)N |
Product Overview
N~1~-{(1E)-[4-(methylthio)phenyl]methylene}-1H-tetrazole-1,5-diamine (CAS 5848-48-6), with molecular formula C9H10N6S and molecular weight 234.07 g/mol. IUPAC: 1-[(E)-(4-methylsulfanylphenyl)methylideneamino]tetrazol-5-amine.
Chemical Property Profile of N~1~-{(1E)-[4-(methylthio)phenyl]methylene}-1H-tetrazole-1,5-diamine
Property Insights of N~1~-{(1E)-[4-(methylthio)phenyl]methylene}-1H-tetrazole-1,5-diamine
The XLogP value of 0.8594 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N~1~-{(1E)-[4-(methylthio)phenyl]methylene}-1H-tetrazole-1,5-diamine. The TPSA of 81.98 Ų falls within the moderate polarity range, balancing permeability and solubility for N~1~-{(1E)-[4-(methylthio)phenyl]methylene}-1H-tetrazole-1,5-diamine. Following Lipinski's Rule of Five, N~1~-{(1E)-[4-(methylthio)phenyl]methylene}-1H-tetrazole-1,5-diamine 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 N~1~-{(1E)-[4-(methylthio)phenyl]methylene}-1H-tetrazole-1,5-diamine?
The CAS number of N~1~-{(1E)-[4-(methylthio)phenyl]methylene}-1H-tetrazole-1,5-diamine is 5848-48-6.
What is the molecular formula of N~1~-{(1E)-[4-(methylthio)phenyl]methylene}-1H-tetrazole-1,5-diamine?
The molecular formula of N~1~-{(1E)-[4-(methylthio)phenyl]methylene}-1H-tetrazole-1,5-diamine is C9H10N6S.
What is the molecular weight of N~1~-{(1E)-[4-(methylthio)phenyl]methylene}-1H-tetrazole-1,5-diamine?
The molecular weight of N~1~-{(1E)-[4-(methylthio)phenyl]methylene}-1H-tetrazole-1,5-diamine is 234.07 g/mol.
Where can I buy N~1~-{(1E)-[4-(methylthio)phenyl]methylene}-1H-tetrazole-1,5-diamine?
You can request a quote for N~1~-{(1E)-[4-(methylthio)phenyl]methylene}-1H-tetrazole-1,5-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N~1~-{(1E)-[4-(methylthio)phenyl]methylene}-1H-tetrazole-1,5-diamine?
Yes, KEHONG BIO provides custom synthesis services for N~1~-{(1E)-[4-(methylthio)phenyl]methylene}-1H-tetrazole-1,5-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.