N-Cyclohexyl-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide
TL;DR: N-Cyclohexyl-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide (CAS 442872-69-7) is a chemical compound with molecular formula C14H18N2O2S3 and molecular weight 342.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclohexyl-2-methylsulfanyl-1,3-benzothiazole-6-sulfonamide
Also Known As: N-Cyclohexyl-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide, N-cyclohexyl-2-(methylthio)-1,3-benzothiazole-6-sulfonamide, AH-487/41280522, N-cyclohexyl-2-methylsulfanyl-1,3-benzothiazole-6-sulfonamide, cyclohexyl[(2-methylthiobenzothiazol-6-yl)sulfonyl]amine
| Molecular Formula | C14H18N2O2S3 |
|---|---|
| Molecular Weight | 342.05 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.05304 |
| Heavy Atoms | 21 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 442872-69-7 |
|---|---|
| SMILES | CSC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)NC3CCCCC3 |
| InChIKey | OQZHWXPRMUYGEB-UHFFFAOYSA-N |
Product Overview
N-Cyclohexyl-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide (CAS 442872-69-7), with molecular formula C14H18N2O2S3 and molecular weight 342.05 g/mol. IUPAC: N-cyclohexyl-2-methylsulfanyl-1,3-benzothiazole-6-sulfonamide.
Chemical Property Profile of N-Cyclohexyl-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide
Property Insights of N-Cyclohexyl-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide
The XLogP value of 4.0 indicates that N-Cyclohexyl-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Cyclohexyl-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide. Following Lipinski's Rule of Five, N-Cyclohexyl-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide 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 N-Cyclohexyl-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide?
The CAS number of N-Cyclohexyl-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide is 442872-69-7.
What is the molecular formula of N-Cyclohexyl-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide?
The molecular formula of N-Cyclohexyl-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide is C14H18N2O2S3.
What is the molecular weight of N-Cyclohexyl-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide?
The molecular weight of N-Cyclohexyl-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide is 342.05 g/mol.
Where can I buy N-Cyclohexyl-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide?
You can request a quote for N-Cyclohexyl-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Cyclohexyl-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-Cyclohexyl-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.