5H-Tetrazole-5-thione, 1,4-dihydro-1,4-dimethyl-
TL;DR: 5H-Tetrazole-5-thione, 1,4-dihydro-1,4-dimethyl- (CAS 54986-14-0) is a chemical compound with molecular formula C3H6N4S and molecular weight 130.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dimethyltetrazole-5-thione
Also Known As: 1,4-dimethyltetrazole-5-thione, 1,4-Dimethyl-2-tetrazolin-5-thion, 5-thioxo-1,4-dimethyl-1,4-dihydro-5H-tetrazole, 1,4-Dimethyl-1,4-dihydro-5H-tetrazole-5-thione, dimethyl-4,5-dihydro-1H-1,2,3,4-tetrazole-5-thione
| Molecular Formula | C3H6N4S |
|---|---|
| Molecular Weight | 130.03 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 130.03131 |
| Heavy Atoms | 8 |
| Complexity | 128.0 |
Chemical Identifiers
| CAS Number | 54986-14-0 |
|---|---|
| SMILES | CN1C(=S)N(N=N1)C |
| InChIKey | QOPRFSKDPFXBLC-UHFFFAOYSA-N |
Product Overview
5H-Tetrazole-5-thione, 1,4-dihydro-1,4-dimethyl- (CAS 54986-14-0), with molecular formula C3H6N4S and molecular weight 130.03 g/mol. IUPAC: 1,4-dimethyltetrazole-5-thione.
Chemical Property Profile of 5H-Tetrazole-5-thione, 1,4-dihydro-1,4-dimethyl-
Property Insights of 5H-Tetrazole-5-thione, 1,4-dihydro-1,4-dimethyl-
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5H-Tetrazole-5-thione, 1,4-dihydro-1,4-dimethyl-. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5H-Tetrazole-5-thione, 1,4-dihydro-1,4-dimethyl-. Following Lipinski's Rule of Five, 5H-Tetrazole-5-thione, 1,4-dihydro-1,4-dimethyl- has 0 hydrogen bond donor(s) and 3 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 5H-Tetrazole-5-thione, 1,4-dihydro-1,4-dimethyl-?
The CAS number of 5H-Tetrazole-5-thione, 1,4-dihydro-1,4-dimethyl- is 54986-14-0.
What is the molecular formula of 5H-Tetrazole-5-thione, 1,4-dihydro-1,4-dimethyl-?
The molecular formula of 5H-Tetrazole-5-thione, 1,4-dihydro-1,4-dimethyl- is C3H6N4S.
What is the molecular weight of 5H-Tetrazole-5-thione, 1,4-dihydro-1,4-dimethyl-?
The molecular weight of 5H-Tetrazole-5-thione, 1,4-dihydro-1,4-dimethyl- is 130.03 g/mol.
Where can I buy 5H-Tetrazole-5-thione, 1,4-dihydro-1,4-dimethyl-?
You can request a quote for 5H-Tetrazole-5-thione, 1,4-dihydro-1,4-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5H-Tetrazole-5-thione, 1,4-dihydro-1,4-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 5H-Tetrazole-5-thione, 1,4-dihydro-1,4-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.