5-Isoquinolinesulfonyl chloride
TL;DR: 5-Isoquinolinesulfonyl chloride (CAS 84468-15-5) is a chemical compound with molecular formula C9H6ClNO2S and molecular weight 226.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
isoquinoline-5-sulfonyl chloride
Also Known As: Isoquinoline-5-sulfonyl Chloride, 5-Isoquinolinesulfonyl chloride, Isoquinoline-5-sulfonylchloride, 2,6-Bis(bromomethyl)pyridine, ISOQUINOLINE IMPURITY 6
| Molecular Formula | C9H6ClNO2S |
|---|---|
| Molecular Weight | 226.98 g/mol |
| LogP | 2.1623 |
| Topological Polar Surface Area | 47.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 226.98077 |
| Heavy Atoms | 14 |
| Complexity | 574.8866 |
Chemical Identifiers
| CAS Number | 84468-15-5 |
|---|---|
| SMILES | C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)Cl |
Product Overview
5-Isoquinolinesulfonyl chloride (CAS 84468-15-5), with molecular formula C9H6ClNO2S and molecular weight 226.98 g/mol. IUPAC: isoquinoline-5-sulfonyl chloride.
Chemical Property Profile of 5-Isoquinolinesulfonyl chloride
Property Insights of 5-Isoquinolinesulfonyl chloride
The XLogP value of 2.1623 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Isoquinolinesulfonyl chloride. With a topological polar surface area (TPSA) of 47.03 Ų, 5-Isoquinolinesulfonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Isoquinolinesulfonyl chloride 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
Frequently Asked Questions
What is the CAS number of 5-Isoquinolinesulfonyl chloride?
The CAS number of 5-Isoquinolinesulfonyl chloride is 84468-15-5.
What is the molecular formula of 5-Isoquinolinesulfonyl chloride?
The molecular formula of 5-Isoquinolinesulfonyl chloride is C9H6ClNO2S.
What is the molecular weight of 5-Isoquinolinesulfonyl chloride?
The molecular weight of 5-Isoquinolinesulfonyl chloride is 226.98 g/mol.
Where can I buy 5-Isoquinolinesulfonyl chloride?
You can request a quote for 5-Isoquinolinesulfonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Isoquinolinesulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 5-Isoquinolinesulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.