Isoquinoline-5-sulfonamide
TL;DR: Isoquinoline-5-sulfonamide (CAS 109547-31-1) is a chemical compound with molecular formula C9H8N2O2S and molecular weight 208.03065 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
isoquinoline-5-sulfonamide
Also Known As: Isoquinoline-5-sulfonamide, 5-Isoquinolinesulfonamide, 5-isoquinolinylsulfonamide, 7CB, 842-005-8
Technical Specifications
| Molecular Formula | C9H8N2O2S |
| Molecular Weight | 208.03065 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 81.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 208.03065 Da |
| Heavy Atoms | 14 |
| Complexity | 296.0 |
| SMILES | C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)N |
| InChIKey | BFIWZEKPARJYJE-UHFFFAOYSA-N |
Chemical Property Profile of Isoquinoline-5-sulfonamide
Property Insights of Isoquinoline-5-sulfonamide
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isoquinoline-5-sulfonamide. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Isoquinoline-5-sulfonamide. Following Lipinski's Rule of Five, Isoquinoline-5-sulfonamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Isoquinoline-5-sulfonamide?
The CAS number of Isoquinoline-5-sulfonamide is 109547-31-1.
What is the molecular formula of Isoquinoline-5-sulfonamide?
The molecular formula of Isoquinoline-5-sulfonamide is C9H8N2O2S.
What is the molecular weight of Isoquinoline-5-sulfonamide?
The molecular weight of Isoquinoline-5-sulfonamide is 208.03065 g/mol.
Where can I buy Isoquinoline-5-sulfonamide?
You can request a quote for Isoquinoline-5-sulfonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isoquinoline-5-sulfonamide?
Yes, CoreyChem provides custom synthesis services for Isoquinoline-5-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.