Phenothiazin-5-ium
TL;DR: Phenothiazin-5-ium (CAS 261-89-2) is a chemical compound with molecular formula C12H8NS+ and molecular weight 198.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenothiazin-5-ium
Also Known As: phenothiazin-5-ium, Phenothiazine-5-ium, PHENOTHIAZINE, 5lambda4-phenothiazin-5-ylium, J1.713.604F
| Molecular Formula | C12H8NS+ |
|---|---|
| Molecular Weight | 198.04 g/mol |
| LogP | 3.7306 |
| Topological Polar Surface Area | 12.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 198.03775 |
| Heavy Atoms | 14 |
| Complexity | 499.0425 |
Chemical Identifiers
| CAS Number | 261-89-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C3C=CC=CC3=[S+]2 |
Product Overview
Phenothiazin-5-ium (CAS 261-89-2), with molecular formula C12H8NS+ and molecular weight 198.04 g/mol. IUPAC: phenothiazin-5-ium.
Chemical Property Profile of Phenothiazin-5-ium
Property Insights of Phenothiazin-5-ium
The XLogP value of 3.7306 indicates that Phenothiazin-5-ium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.89 Ų, Phenothiazin-5-ium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenothiazin-5-ium has 0 hydrogen bond donor(s) and 1 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 Phenothiazin-5-ium?
The CAS number of Phenothiazin-5-ium is 261-89-2.
What is the molecular formula of Phenothiazin-5-ium?
The molecular formula of Phenothiazin-5-ium is C12H8NS+.
What is the molecular weight of Phenothiazin-5-ium?
The molecular weight of Phenothiazin-5-ium is 198.04 g/mol.
Where can I buy Phenothiazin-5-ium?
You can request a quote for Phenothiazin-5-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenothiazin-5-ium?
Yes, KEHONG BIO provides custom synthesis services for Phenothiazin-5-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.