2-(1-Methyltetrazol-5-yl)sulfanyl-5-nitropyridine
TL;DR: 2-(1-Methyltetrazol-5-yl)sulfanyl-5-nitropyridine (CAS 444791-47-3) is a chemical compound with molecular formula C7H6N6O2S and molecular weight 238.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-methyltetrazol-5-yl)sulfanyl-5-nitropyridine
Also Known As: 2-(1-methyltetrazol-5-yl)sulfanyl-5-nitropyridine, 5-nitro-2-[(1-methyl-1H-tetraazol-5-yl)sulfanyl]pyridine, AI-204/31688022, 2-(1-methyltetrazol-5-yl)sulfanyl-5-nitro-pyridine
| Molecular Formula | C7H6N6O2S |
|---|---|
| Molecular Weight | 238.03 g/mol |
| LogP | 0.6645 |
| Topological Polar Surface Area | 99.63 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.0273 |
| Heavy Atoms | 16 |
| Complexity | 509.85052 |
Chemical Identifiers
| CAS Number | 444791-47-3 |
|---|---|
| SMILES | CN1C(=NN=N1)SC2=NC=C(C=C2)[N+](=O)[O-] |
Product Overview
2-(1-Methyltetrazol-5-yl)sulfanyl-5-nitropyridine (CAS 444791-47-3), with molecular formula C7H6N6O2S and molecular weight 238.03 g/mol. IUPAC: 2-(1-methyltetrazol-5-yl)sulfanyl-5-nitropyridine.
Chemical Property Profile of 2-(1-Methyltetrazol-5-yl)sulfanyl-5-nitropyridine
Property Insights of 2-(1-Methyltetrazol-5-yl)sulfanyl-5-nitropyridine
The XLogP value of 0.6645 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-Methyltetrazol-5-yl)sulfanyl-5-nitropyridine. The TPSA of 99.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1-Methyltetrazol-5-yl)sulfanyl-5-nitropyridine. Following Lipinski's Rule of Five, 2-(1-Methyltetrazol-5-yl)sulfanyl-5-nitropyridine has 0 hydrogen bond donor(s) and 7 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-(1-Methyltetrazol-5-yl)sulfanyl-5-nitropyridine?
The CAS number of 2-(1-Methyltetrazol-5-yl)sulfanyl-5-nitropyridine is 444791-47-3.
What is the molecular formula of 2-(1-Methyltetrazol-5-yl)sulfanyl-5-nitropyridine?
The molecular formula of 2-(1-Methyltetrazol-5-yl)sulfanyl-5-nitropyridine is C7H6N6O2S.
What is the molecular weight of 2-(1-Methyltetrazol-5-yl)sulfanyl-5-nitropyridine?
The molecular weight of 2-(1-Methyltetrazol-5-yl)sulfanyl-5-nitropyridine is 238.03 g/mol.
Where can I buy 2-(1-Methyltetrazol-5-yl)sulfanyl-5-nitropyridine?
You can request a quote for 2-(1-Methyltetrazol-5-yl)sulfanyl-5-nitropyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-Methyltetrazol-5-yl)sulfanyl-5-nitropyridine?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-Methyltetrazol-5-yl)sulfanyl-5-nitropyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.