![2-[(4-Methanesulfonyl-2-nitrophenyl)sulfanyl]-1,3-benzothiazole structure](/static/products/3257/325703-58-0.webp)
2-[(4-Methanesulfonyl-2-nitrophenyl)sulfanyl]-1,3-benzothiazole
TL;DR: 2-[(4-Methanesulfonyl-2-nitrophenyl)sulfanyl]-1,3-benzothiazole (CAS 325703-58-0) is a chemical compound with molecular formula C14H10N2O4S3 and molecular weight 365.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylsulfonyl-2-nitrophenyl)sulfanyl-1,3-benzothiazole
Also Known As: 2-[(4-methanesulfonyl-2-nitrophenyl)sulfanyl]-1,3-benzothiazole, 2-((4-(methylsulfonyl)-2-nitrophenyl)thio)benzo[d]thiazole, 2-(4-methylsulfonyl-2-nitrophenyl)sulfanyl-1,3-benzothiazole, 2-{[4-(methylsulfonyl)-2-nitrophenyl]thio}-1,3-benzothiazole, 1-benzothiazol-2-ylthio-4-(methylsulfonyl)-2-nitrobenzene
| Molecular Formula | C14H10N2O4S3 |
|---|---|
| Molecular Weight | 365.98 g/mol |
| LogP | 3.7592 |
| Topological Polar Surface Area | 90.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 365.98026 |
| Heavy Atoms | 23 |
| Complexity | 978.78925 |
Chemical Identifiers
| CAS Number | 325703-58-0 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC(=C(C=C1)SC2=NC3=CC=CC=C3S2)[N+](=O)[O-] |
Product Overview
2-[(4-Methanesulfonyl-2-nitrophenyl)sulfanyl]-1,3-benzothiazole (CAS 325703-58-0), with molecular formula C14H10N2O4S3 and molecular weight 365.98 g/mol. IUPAC: 2-(4-methylsulfonyl-2-nitrophenyl)sulfanyl-1,3-benzothiazole.
Chemical Property Profile of 2-[(4-Methanesulfonyl-2-nitrophenyl)sulfanyl]-1,3-benzothiazole
Property Insights of 2-[(4-Methanesulfonyl-2-nitrophenyl)sulfanyl]-1,3-benzothiazole
The XLogP value of 3.7592 indicates that 2-[(4-Methanesulfonyl-2-nitrophenyl)sulfanyl]-1,3-benzothiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-Methanesulfonyl-2-nitrophenyl)sulfanyl]-1,3-benzothiazole. Following Lipinski's Rule of Five, 2-[(4-Methanesulfonyl-2-nitrophenyl)sulfanyl]-1,3-benzothiazole has 0 hydrogen bond donor(s) and 7 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 2-[(4-Methanesulfonyl-2-nitrophenyl)sulfanyl]-1,3-benzothiazole?
The CAS number of 2-[(4-Methanesulfonyl-2-nitrophenyl)sulfanyl]-1,3-benzothiazole is 325703-58-0.
What is the molecular formula of 2-[(4-Methanesulfonyl-2-nitrophenyl)sulfanyl]-1,3-benzothiazole?
The molecular formula of 2-[(4-Methanesulfonyl-2-nitrophenyl)sulfanyl]-1,3-benzothiazole is C14H10N2O4S3.
What is the molecular weight of 2-[(4-Methanesulfonyl-2-nitrophenyl)sulfanyl]-1,3-benzothiazole?
The molecular weight of 2-[(4-Methanesulfonyl-2-nitrophenyl)sulfanyl]-1,3-benzothiazole is 365.98 g/mol.
Where can I buy 2-[(4-Methanesulfonyl-2-nitrophenyl)sulfanyl]-1,3-benzothiazole?
You can request a quote for 2-[(4-Methanesulfonyl-2-nitrophenyl)sulfanyl]-1,3-benzothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Methanesulfonyl-2-nitrophenyl)sulfanyl]-1,3-benzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Methanesulfonyl-2-nitrophenyl)sulfanyl]-1,3-benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.