RefChem:319121
TL;DR: RefChem:319121 (CAS 75078-41-0) is a chemical compound with molecular formula C26H38N4O10S3 and molecular weight 662.175 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl sulfate;trimethyl-[[3-[[5-[(trimethylazaniumyl)methyl]-1H-indol-3-yl]sulfonyl]-1H-indol-5-yl]methyl]azanium
Also Known As: Bis(3-dimethylaminomethyl-5-indolyl)sulfone methosulfate, Ammonium, (sulfonylbis(indole-3,5-diylmethylene))bis(trimethyl-, bismethanesulfate, methyl sulfate; trimethyl-[[3-[[5-[(trimethylazaniumyl)methyl]-1H-indol-3-yl]sulfonyl]-1H-indol-5-yl]methyl]azanium, N,N'-[Sulfonylbis(1H-indole-3,5-diylmethylene)]bis(N,N-dimethylmethanaminium) bis(methyl sulfate)
Technical Specifications
| Molecular Formula | C26H38N4O10S3 |
| Molecular Weight | 662.175 g/mol |
| XLogP | 2.08 |
| Topological Polar Surface Area (TPSA) | 224.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 662.175 Da |
| Heavy Atoms | 43 |
| Complexity | 771.0 |
| SMILES | C[N+](C)(C)CC1=CC2=C(C=C1)NC=C2S(=O)(=O)C3=CNC4=C3C=C(C=C4)C[N+](C)(C)C.COS(=O)(=O)[O-].COS(=O)(=O)[O-] |
| InChIKey | MSIHXLLDUILXGI-UHFFFAOYSA-L |
Chemical Property Profile of RefChem:319121
Property Insights of RefChem:319121
The XLogP value of 2.08 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:319121. The TPSA of 224.0 Ų indicates high polarity, suggesting RefChem:319121 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:319121 has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:319121?
The CAS number of RefChem:319121 is 75078-41-0.
What is the molecular formula of RefChem:319121?
The molecular formula of RefChem:319121 is C26H38N4O10S3.
What is the molecular weight of RefChem:319121?
The molecular weight of RefChem:319121 is 662.175 g/mol.
Where can I buy RefChem:319121?
You can request a quote for RefChem:319121 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:319121?
Yes, CoreyChem provides custom synthesis services for RefChem:319121 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.