Secergan
TL;DR: Secergan (CAS 298-48-6) is a chemical compound with molecular formula C18H21BrN2OS and molecular weight 392.0558 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trimethyl-(1-oxo-1-phenothiazin-10-ylpropan-2-yl)azanium bromide
Also Known As: Secergan, Ammonium, bromide, Astra 1470, Phenthimentonium bromide, (1-(10-Phenothiazinylcarbonyl)ethyl)trimethylammonium bromide
Technical Specifications
| Molecular Formula | C18H21BrN2OS |
| Molecular Weight | 392.0558 g/mol |
| XLogP | 0.91 |
| Topological Polar Surface Area (TPSA) | 45.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 392.0558 Da |
| Heavy Atoms | 23 |
| Complexity | 398.0 |
| SMILES | CC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)[N+](C)(C)C.[Br-] |
| InChIKey | RLTKVEPESLKRSA-UHFFFAOYSA-M |
Product Description
Applications: Secergan is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A fine chemical supplied by CoreyChem, Secergan (CAS 298-48-6) has the molecular formula C18H21BrN2OS and a molecular weight of 392.06 g/mol. Synonyms include Secergan and Ammonium, bromide.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Secergan
Property Insights of Secergan
The XLogP value of 0.91 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Secergan. With a topological polar surface area (TPSA) of 45.6 Ų, Secergan exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Secergan 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
What is the CAS number of Secergan?
The CAS number of Secergan is 298-48-6.
What is the molecular formula of Secergan?
The molecular formula of Secergan is C18H21BrN2OS.
What is the molecular weight of Secergan?
The molecular weight of Secergan is 392.0558 g/mol.
What are the applications of Secergan?
Secergan is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Where can I buy Secergan?
You can request a quote for Secergan directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Secergan?
Yes, CoreyChem provides custom synthesis services for Secergan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.