2H-Naphth(1,8-cd)isothiazole-3,5-disulfonic acid, 1,1-dioxide
TL;DR: 2H-Naphth(1,8-cd)isothiazole-3,5-disulfonic acid, 1,1-dioxide (CAS 82-65-5) is a chemical compound with molecular formula C10H7NO8S3 and molecular weight 364.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dioxo-2λ6-thia-3-azatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaene-5,7-disulfonic acid
Also Known As: 2H-Naphth[1,8-cd]isothiazole-3,5-disulfonic acid, 1,1-dioxide, 2H-Naphth(1,8-cd)isothiazole-3,5-disulfonic acid, 1,1-dioxide, 2H-Naphth[1,8-cd]isothiazole-3,5-disulfonicacid, 1,1-dioxide, 2,2-dioxo-2lambda6-thia-3-azatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaene-5,7-disulfonic acid, 4,5-(Iminosulfonyl)-1,3-naphthalenedisulfonic acid
| Molecular Formula | C10H7NO8S3 |
|---|---|
| Molecular Weight | 364.93 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 180.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 364.93338 |
| Heavy Atoms | 22 |
| Complexity | 769.0 |
Chemical Identifiers
| CAS Number | 82-65-5 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)S(=O)(=O)NC3=C(C=C2S(=O)(=O)O)S(=O)(=O)O |
| InChIKey | SOEOLOYSOQPCII-UHFFFAOYSA-N |
Product Overview
2H-Naphth(1,8-cd)isothiazole-3,5-disulfonic acid, 1,1-dioxide (CAS 82-65-5), with molecular formula C10H7NO8S3 and molecular weight 364.93 g/mol. IUPAC: 2,2-dioxo-2λ6-thia-3-azatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaene-5,7-disulfonic acid.
Chemical Property Profile of 2H-Naphth(1,8-cd)isothiazole-3,5-disulfonic acid, 1,1-dioxide
Property Insights of 2H-Naphth(1,8-cd)isothiazole-3,5-disulfonic acid, 1,1-dioxide
The XLogP value of -0.7 indicates that 2H-Naphth(1,8-cd)isothiazole-3,5-disulfonic acid, 1,1-dioxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 180.0 Ų indicates high polarity, suggesting 2H-Naphth(1,8-cd)isothiazole-3,5-disulfonic acid, 1,1-dioxide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2H-Naphth(1,8-cd)isothiazole-3,5-disulfonic acid, 1,1-dioxide has 3 hydrogen bond donor(s) and 9 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 2H-Naphth(1,8-cd)isothiazole-3,5-disulfonic acid, 1,1-dioxide?
The CAS number of 2H-Naphth(1,8-cd)isothiazole-3,5-disulfonic acid, 1,1-dioxide is 82-65-5.
What is the molecular formula of 2H-Naphth(1,8-cd)isothiazole-3,5-disulfonic acid, 1,1-dioxide?
The molecular formula of 2H-Naphth(1,8-cd)isothiazole-3,5-disulfonic acid, 1,1-dioxide is C10H7NO8S3.
What is the molecular weight of 2H-Naphth(1,8-cd)isothiazole-3,5-disulfonic acid, 1,1-dioxide?
The molecular weight of 2H-Naphth(1,8-cd)isothiazole-3,5-disulfonic acid, 1,1-dioxide is 364.93 g/mol.
Where can I buy 2H-Naphth(1,8-cd)isothiazole-3,5-disulfonic acid, 1,1-dioxide?
You can request a quote for 2H-Naphth(1,8-cd)isothiazole-3,5-disulfonic acid, 1,1-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-Naphth(1,8-cd)isothiazole-3,5-disulfonic acid, 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 2H-Naphth(1,8-cd)isothiazole-3,5-disulfonic acid, 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.