RefChem:318722
TL;DR: RefChem:318722 (CAS 66827-25-6) is a chemical compound with molecular formula C24H29N3O3S2 and molecular weight 471.16504 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methylbenzenesulfonate;trimethyl(2-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)azanium
Also Known As: D 271, Ammonium, (2-(10H-pyrido(3,2-b)(1,4)benzothiazin-10-yl)propyl)trimethyl-, p-toluenesulfonate, 4-methylbenzenesulfonate; trimethyl(2-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)azanium, 10H-Pyrido[3,2-b][1,4]benzothiazine-10-ethanaminium, N,N,N,.beta.-tetramethyl-, salt with 4-methylbenzenesulfonic acid (1:1), N,N,N-Trimethyl-2-(10H-pyrido[3,2-b][1,4]benzothiazin-10-yl)propan-1-aminium 4-methylbenzene-1-sulfonate
Technical Specifications
| Molecular Formula | C24H29N3O3S2 |
| Molecular Weight | 471.16504 g/mol |
| XLogP | 4.68 |
| Topological Polar Surface Area (TPSA) | 107.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 471.16504 Da |
| Heavy Atoms | 32 |
| Complexity | 547.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)[O-].CC(C[N+](C)(C)C)N1C2=CC=CC=C2SC3=C1N=CC=C3 |
| InChIKey | SREYQHWWIMDPFO-UHFFFAOYSA-M |
Chemical Property Profile of RefChem:318722
Property Insights of RefChem:318722
The XLogP value of 4.68 indicates that RefChem:318722 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:318722. Following Lipinski's Rule of Five, RefChem:318722 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:318722?
The CAS number of RefChem:318722 is 66827-25-6.
What is the molecular formula of RefChem:318722?
The molecular formula of RefChem:318722 is C24H29N3O3S2.
What is the molecular weight of RefChem:318722?
The molecular weight of RefChem:318722 is 471.16504 g/mol.
Where can I buy RefChem:318722?
You can request a quote for RefChem:318722 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:318722?
Yes, CoreyChem provides custom synthesis services for RefChem:318722 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.