Ammonium, tetramethyl-, benzothiazole-2-mercaptide
TL;DR: Ammonium, tetramethyl-, benzothiazole-2-mercaptide (CAS 73636-99-4) is a chemical compound with molecular formula C11H16N2S2 and molecular weight 240.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-benzothiazole-2-thiolate;tetramethylazanium
Also Known As: Tetramethylammonium benzothiazol-2-mercaptide, AMMONIUM, TETRAMETHYL-, BENZOTHIAZOLE-2-MERCAPTIDE, 1,3-benzothiazole-2-thiolate; tetramethylazanium, N,N,N-Trimethylmethanaminium 1,3-benzothiazole-2-thiolate, Methanaminium, N,N,N-trimethyl-, salt with 2(3H)-benzothiazolethione (1:1)
| Molecular Formula | C11H16N2S2 |
|---|---|
| Molecular Weight | 240.08 g/mol |
| LogP | 2.52 |
| Topological Polar Surface Area | 42.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 240.07549 |
| Heavy Atoms | 15 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 73636-99-4 |
|---|---|
| SMILES | C[N+](C)(C)C.C1=CC=C2C(=C1)N=C(S2)[S-] |
| InChIKey | SKJOLQWAHHRXRH-UHFFFAOYSA-M |
Product Overview
Ammonium, tetramethyl-, benzothiazole-2-mercaptide (CAS 73636-99-4), with molecular formula C11H16N2S2 and molecular weight 240.08 g/mol. IUPAC: 1,3-benzothiazole-2-thiolate;tetramethylazanium.
Chemical Property Profile of Ammonium, tetramethyl-, benzothiazole-2-mercaptide
Property Insights of Ammonium, tetramethyl-, benzothiazole-2-mercaptide
The XLogP value of 2.52 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, tetramethyl-, benzothiazole-2-mercaptide. With a topological polar surface area (TPSA) of 42.1 Ų, Ammonium, tetramethyl-, benzothiazole-2-mercaptide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, tetramethyl-, benzothiazole-2-mercaptide 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 Ammonium, tetramethyl-, benzothiazole-2-mercaptide?
The CAS number of Ammonium, tetramethyl-, benzothiazole-2-mercaptide is 73636-99-4.
What is the molecular formula of Ammonium, tetramethyl-, benzothiazole-2-mercaptide?
The molecular formula of Ammonium, tetramethyl-, benzothiazole-2-mercaptide is C11H16N2S2.
What is the molecular weight of Ammonium, tetramethyl-, benzothiazole-2-mercaptide?
The molecular weight of Ammonium, tetramethyl-, benzothiazole-2-mercaptide is 240.08 g/mol.
Where can I buy Ammonium, tetramethyl-, benzothiazole-2-mercaptide?
You can request a quote for Ammonium, tetramethyl-, benzothiazole-2-mercaptide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, tetramethyl-, benzothiazole-2-mercaptide?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, tetramethyl-, benzothiazole-2-mercaptide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.