1-tert-butyl-2,5-dihydro-1H-1,2,3,4-tetrazole-5-thione
TL;DR: 1-tert-butyl-2,5-dihydro-1H-1,2,3,4-tetrazole-5-thione (CAS 7624-35-3) is a chemical compound with molecular formula C5H10N4S and molecular weight 158.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butyl-2H-tetrazole-5-thione
Also Known As: 1-tert-butyl-1H-tetrazole-5-thiol, Maybridge1_007053, 1-tert-butyl-1H-1,2,3,4-tetrazole-5-thiol, 1-tert-butyl-2H-tetrazole-5-thione, 1-t-butyltetrazole-5-thiol
| Molecular Formula | C5H10N4S |
|---|---|
| Molecular Weight | 158.06 g/mol |
| LogP | 1.09069 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 158.06262 |
| Heavy Atoms | 10 |
| Complexity | 265.6656 |
Chemical Identifiers
| CAS Number | 7624-35-3 |
|---|---|
| SMILES | CC(C)(C)N1C(=S)N=NN1 |
Product Overview
1-tert-butyl-2,5-dihydro-1H-1,2,3,4-tetrazole-5-thione (CAS 7624-35-3), with molecular formula C5H10N4S and molecular weight 158.06 g/mol. IUPAC: 1-tert-butyl-2H-tetrazole-5-thione.
Chemical Property Profile of 1-tert-butyl-2,5-dihydro-1H-1,2,3,4-tetrazole-5-thione
Property Insights of 1-tert-butyl-2,5-dihydro-1H-1,2,3,4-tetrazole-5-thione
The XLogP value of 1.09069 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-tert-butyl-2,5-dihydro-1H-1,2,3,4-tetrazole-5-thione. With a topological polar surface area (TPSA) of 46.5 Ų, 1-tert-butyl-2,5-dihydro-1H-1,2,3,4-tetrazole-5-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-tert-butyl-2,5-dihydro-1H-1,2,3,4-tetrazole-5-thione has 1 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 1-tert-butyl-2,5-dihydro-1H-1,2,3,4-tetrazole-5-thione?
The CAS number of 1-tert-butyl-2,5-dihydro-1H-1,2,3,4-tetrazole-5-thione is 7624-35-3.
What is the molecular formula of 1-tert-butyl-2,5-dihydro-1H-1,2,3,4-tetrazole-5-thione?
The molecular formula of 1-tert-butyl-2,5-dihydro-1H-1,2,3,4-tetrazole-5-thione is C5H10N4S.
What is the molecular weight of 1-tert-butyl-2,5-dihydro-1H-1,2,3,4-tetrazole-5-thione?
The molecular weight of 1-tert-butyl-2,5-dihydro-1H-1,2,3,4-tetrazole-5-thione is 158.06 g/mol.
Where can I buy 1-tert-butyl-2,5-dihydro-1H-1,2,3,4-tetrazole-5-thione?
You can request a quote for 1-tert-butyl-2,5-dihydro-1H-1,2,3,4-tetrazole-5-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-tert-butyl-2,5-dihydro-1H-1,2,3,4-tetrazole-5-thione?
Yes, KEHONG BIO provides custom synthesis services for 1-tert-butyl-2,5-dihydro-1H-1,2,3,4-tetrazole-5-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.