1-Naphthalen-2-yl-1H-tetrazole-5-thiol
TL;DR: 1-Naphthalen-2-yl-1H-tetrazole-5-thiol (CAS 38560-12-2) is a chemical compound with molecular formula C11H8N4S and molecular weight 228.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-naphthalen-2-yl-2H-tetrazole-5-thione
Also Known As: 1-Naphthalen-2-yl-1H-tetrazole-5-thiol, BAS 03606605, 1-naphthalen-2-yl-2H-tetrazole-5-thione, 1-[2]naphthyl-1,4-dihydro-tetrazolethione, 1-(2-naphthyl)-1,2,3,4-tetraazole-5-thiol
| Molecular Formula | C11H8N4S |
|---|---|
| Molecular Weight | 228.05 g/mol |
| LogP | 2.47809 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 228.04697 |
| Heavy Atoms | 16 |
| Complexity | 698.026 |
Chemical Identifiers
| CAS Number | 38560-12-2 |
|---|---|
| SMILES | C1=CC=C2C=C(C=CC2=C1)N3C(=S)N=NN3 |
Product Overview
1-Naphthalen-2-yl-1H-tetrazole-5-thiol (CAS 38560-12-2), with molecular formula C11H8N4S and molecular weight 228.05 g/mol. IUPAC: 1-naphthalen-2-yl-2H-tetrazole-5-thione.
Chemical Property Profile of 1-Naphthalen-2-yl-1H-tetrazole-5-thiol
Property Insights of 1-Naphthalen-2-yl-1H-tetrazole-5-thiol
The XLogP value of 2.47809 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Naphthalen-2-yl-1H-tetrazole-5-thiol. With a topological polar surface area (TPSA) of 46.5 Ų, 1-Naphthalen-2-yl-1H-tetrazole-5-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Naphthalen-2-yl-1H-tetrazole-5-thiol 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-Naphthalen-2-yl-1H-tetrazole-5-thiol?
The CAS number of 1-Naphthalen-2-yl-1H-tetrazole-5-thiol is 38560-12-2.
What is the molecular formula of 1-Naphthalen-2-yl-1H-tetrazole-5-thiol?
The molecular formula of 1-Naphthalen-2-yl-1H-tetrazole-5-thiol is C11H8N4S.
What is the molecular weight of 1-Naphthalen-2-yl-1H-tetrazole-5-thiol?
The molecular weight of 1-Naphthalen-2-yl-1H-tetrazole-5-thiol is 228.05 g/mol.
Where can I buy 1-Naphthalen-2-yl-1H-tetrazole-5-thiol?
You can request a quote for 1-Naphthalen-2-yl-1H-tetrazole-5-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Naphthalen-2-yl-1H-tetrazole-5-thiol?
Yes, KEHONG BIO provides custom synthesis services for 1-Naphthalen-2-yl-1H-tetrazole-5-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.