RefChem:448420
TL;DR: RefChem:448420 (CAS 52610-09-0) is a chemical compound with molecular formula C11H10Cl2N4O6S2 and molecular weight 427.9419 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]phenyl]sulfonylethyl hydrogen sulfate
Also Known As: Piperidine,1-methyl-4-propyl, 2-((4-((4,6-Dichloro-1,3,5-triazin-2-yl)amino)phenyl)sulphonyl)ethyl hydrogen sulphate, 2-[[4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]phenyl]sulphonyl]ethyl hydrogen sulphate, 2-((4-((4,6-dichloro-1,3,5-triazin-2-yl)amino)phenyl)sulfonyl)ethyl hydrogen sulfate, 2-({4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]phenyl}sulfonyl)ethyl hydrogen sulfate
Technical Specifications
| Molecular Formula | C11H10Cl2N4O6S2 |
| Molecular Weight | 427.9419 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 165.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 427.9419 Da |
| Heavy Atoms | 25 |
| Complexity | 620.0 |
| SMILES | C1=CC(=CC=C1NC2=NC(=NC(=N2)Cl)Cl)S(=O)(=O)CCOS(=O)(=O)O |
| InChIKey | KARQWNJBJZMXNE-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:448420
Property Insights of RefChem:448420
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:448420. The TPSA of 165.0 Ų indicates high polarity, suggesting RefChem:448420 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:448420 has 2 hydrogen bond donor(s) and 10 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:448420?
The CAS number of RefChem:448420 is 52610-09-0.
What is the molecular formula of RefChem:448420?
The molecular formula of RefChem:448420 is C11H10Cl2N4O6S2.
What is the molecular weight of RefChem:448420?
The molecular weight of RefChem:448420 is 427.9419 g/mol.
Where can I buy RefChem:448420?
You can request a quote for RefChem:448420 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:448420?
Yes, CoreyChem provides custom synthesis services for RefChem:448420 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.