![1-甲基-3-氧代-1,3-二氢苯并[c]异噻唑-5-磺酰胺 structure](/static/products/6794/67943-90-2.webp)
1-甲基-3-氧代-1,3-二氢苯并[c]异噻唑-5-磺酰胺
TL;DR: 1-甲基-3-氧代-1,3-二氢苯并[c]异噻唑-5-磺酰胺 (CAS 67943-90-2) is a chemical compound with molecular formula C8H8N2O3S2 and molecular weight 244.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-甲基-3-氧代-1,3-二氢苯并[c]异噻唑-5-磺酰胺
1-methyl-3-oxo-2,1-benzothiazole-5-sulfonamide
Also Known As: 1kwr, LeadQuest Compound 6, 1-methyl-3-oxo-1,3-dihydro-benzo[c]isothiazole-5-sulfonic acid amide, 1-methyl-3-oxo-2,1-benzothiazole-5-sulfonamide, 1-methyl-3-oxo-1,3-dihydrobenzo[c]isothiazole-5-sulfonamide
| Molecular Formula | C8H8N2O3S2 |
|---|---|
| Molecular Weight | 244.00 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 243.99763 |
| Heavy Atoms | 15 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 67943-90-2 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)S(=O)(=O)N)C(=O)S1 |
| InChIKey | DFPYCCVFXMWMJM-UHFFFAOYSA-N |
Product Overview
1-甲基-3-氧代-1,3-二氢苯并[c]异噻唑-5-磺酰胺 (CAS 67943-90-2), with molecular formula C8H8N2O3S2 and molecular weight 244.00 g/mol. IUPAC: 1-methyl-3-oxo-2,1-benzothiazole-5-sulfonamide.
Chemical Property Profile of 1-甲基-3-氧代-1,3-二氢苯并[c]异噻唑-5-磺酰胺
Property Insights of 1-甲基-3-氧代-1,3-二氢苯并[c]异噻唑-5-磺酰胺
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-甲基-3-氧代-1,3-二氢苯并[c]异噻唑-5-磺酰胺. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-甲基-3-氧代-1,3-二氢苯并[c]异噻唑-5-磺酰胺. Following Lipinski's Rule of Five, 1-甲基-3-氧代-1,3-二氢苯并[c]异噻唑-5-磺酰胺 has 1 hydrogen bond donor(s) and 6 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 1-甲基-3-氧代-1,3-二氢苯并[c]异噻唑-5-磺酰胺?
The CAS number of 1-甲基-3-氧代-1,3-二氢苯并[c]异噻唑-5-磺酰胺 is 67943-90-2.
What is the molecular formula of 1-甲基-3-氧代-1,3-二氢苯并[c]异噻唑-5-磺酰胺?
The molecular formula of 1-甲基-3-氧代-1,3-二氢苯并[c]异噻唑-5-磺酰胺 is C8H8N2O3S2.
What is the molecular weight of 1-甲基-3-氧代-1,3-二氢苯并[c]异噻唑-5-磺酰胺?
The molecular weight of 1-甲基-3-氧代-1,3-二氢苯并[c]异噻唑-5-磺酰胺 is 244.00 g/mol.
Where can I buy 1-甲基-3-氧代-1,3-二氢苯并[c]异噻唑-5-磺酰胺?
You can request a quote for 1-甲基-3-氧代-1,3-二氢苯并[c]异噻唑-5-磺酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-甲基-3-氧代-1,3-二氢苯并[c]异噻唑-5-磺酰胺?
Yes, KEHONG BIO provides custom synthesis services for 1-甲基-3-氧代-1,3-二氢苯并[c]异噻唑-5-磺酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.