![Benzothiazolium, 3-methyl-2-[2-(1-piperidinyl)ethenyl]-, chloride (1:1) structure](/static/products/6351/63512-55-0.webp)
Benzothiazolium, 3-methyl-2-[2-(1-piperidinyl)ethenyl]-, chloride (1:1)
TL;DR: Benzothiazolium, 3-methyl-2-[2-(1-piperidinyl)ethenyl]-, chloride (1:1) (CAS 63512-55-0) is a chemical compound with molecular formula C15H19ClN2S and molecular weight 294.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-2-(2-piperidin-1-ylethenyl)-1,3-benzothiazol-3-ium chloride
Also Known As: 3-Methyl-2-(2-piperidinovinyl)benzothiazolium chloride, 3-methyl-2-[2-piperidinovinyl]benzothiazoliumchloride, Benzothiazolium, 3-methyl-2-(2-(1-piperidinyl)ethenyl)-, chloride, 3-METHYL-2-[2-PIPERIDINOVINYL]BENZOTHIAZOLIUM CHLORIDE, Benzothiazolium, 3-methyl-2-(2-(1-piperidinyl)ethenyl)-, chloride (1:1)
| Molecular Formula | C15H19ClN2S |
|---|---|
| Molecular Weight | 294.10 g/mol |
| LogP | 0.19 |
| Topological Polar Surface Area | 35.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 294.09573 |
| Heavy Atoms | 19 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 63512-55-0 |
|---|---|
| SMILES | C[N+]1=C(SC2=CC=CC=C21)C=CN3CCCCC3.[Cl-] |
| InChIKey | IISUOAKTJZTCTI-UHFFFAOYSA-M |
Product Overview
Benzothiazolium, 3-methyl-2-[2-(1-piperidinyl)ethenyl]-, chloride (1:1) (CAS 63512-55-0), with molecular formula C15H19ClN2S and molecular weight 294.10 g/mol. IUPAC: 3-methyl-2-(2-piperidin-1-ylethenyl)-1,3-benzothiazol-3-ium chloride.
Chemical Property Profile of Benzothiazolium, 3-methyl-2-[2-(1-piperidinyl)ethenyl]-, chloride (1:1)
Property Insights of Benzothiazolium, 3-methyl-2-[2-(1-piperidinyl)ethenyl]-, chloride (1:1)
The XLogP value of 0.19 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzothiazolium, 3-methyl-2-[2-(1-piperidinyl)ethenyl]-, chloride (1:1). With a topological polar surface area (TPSA) of 35.4 Ų, Benzothiazolium, 3-methyl-2-[2-(1-piperidinyl)ethenyl]-, chloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzothiazolium, 3-methyl-2-[2-(1-piperidinyl)ethenyl]-, chloride (1:1) 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 Benzothiazolium, 3-methyl-2-[2-(1-piperidinyl)ethenyl]-, chloride (1:1)?
The CAS number of Benzothiazolium, 3-methyl-2-[2-(1-piperidinyl)ethenyl]-, chloride (1:1) is 63512-55-0.
What is the molecular formula of Benzothiazolium, 3-methyl-2-[2-(1-piperidinyl)ethenyl]-, chloride (1:1)?
The molecular formula of Benzothiazolium, 3-methyl-2-[2-(1-piperidinyl)ethenyl]-, chloride (1:1) is C15H19ClN2S.
What is the molecular weight of Benzothiazolium, 3-methyl-2-[2-(1-piperidinyl)ethenyl]-, chloride (1:1)?
The molecular weight of Benzothiazolium, 3-methyl-2-[2-(1-piperidinyl)ethenyl]-, chloride (1:1) is 294.10 g/mol.
Where can I buy Benzothiazolium, 3-methyl-2-[2-(1-piperidinyl)ethenyl]-, chloride (1:1)?
You can request a quote for Benzothiazolium, 3-methyl-2-[2-(1-piperidinyl)ethenyl]-, chloride (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzothiazolium, 3-methyl-2-[2-(1-piperidinyl)ethenyl]-, chloride (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Benzothiazolium, 3-methyl-2-[2-(1-piperidinyl)ethenyl]-, chloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.