N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)-2-nitrobenzamide
TL;DR: N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)-2-nitrobenzamide (CAS 313469-70-4) is a chemical compound with molecular formula C15H11N3O5S2 and molecular weight 377.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-nitrobenzamide
Also Known As: N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)-2-nitrobenzamide, N-(6-METHANESULFONYL-1,3-BENZOTHIAZOL-2-YL)-2-NITROBENZAMIDE, AB00684201-01, N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-nitrobenzamide, F0359-0040
| Molecular Formula | C15H11N3O5S2 |
|---|---|
| Molecular Weight | 377.01 g/mol |
| LogP | 2.8603 |
| Topological Polar Surface Area | 119.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 377.014 |
| Heavy Atoms | 25 |
| Complexity | 1105.3073 |
Chemical Identifiers
| CAS Number | 313469-70-4 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=CC=C3[N+](=O)[O-] |
Product Overview
N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)-2-nitrobenzamide (CAS 313469-70-4), with molecular formula C15H11N3O5S2 and molecular weight 377.01 g/mol. IUPAC: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-nitrobenzamide.
Chemical Property Profile of N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)-2-nitrobenzamide
Property Insights of N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)-2-nitrobenzamide
The XLogP value of 2.8603 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)-2-nitrobenzamide. The TPSA of 119.27 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)-2-nitrobenzamide. Following Lipinski's Rule of Five, N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)-2-nitrobenzamide has 1 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 N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)-2-nitrobenzamide?
The CAS number of N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)-2-nitrobenzamide is 313469-70-4.
What is the molecular formula of N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)-2-nitrobenzamide?
The molecular formula of N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)-2-nitrobenzamide is C15H11N3O5S2.
What is the molecular weight of N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)-2-nitrobenzamide?
The molecular weight of N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)-2-nitrobenzamide is 377.01 g/mol.
Where can I buy N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)-2-nitrobenzamide?
You can request a quote for N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)-2-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)-2-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-(methylsulfonyl)benzo[d]thiazol-2-yl)-2-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.