2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide
TL;DR: 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide (CAS 852916-98-4) is a chemical compound with molecular formula C23H21N3O3S2 and molecular weight 451.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide
Also Known As: 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide, 2-Methyl-N-(6-methyl-2-benzothiazolyl)-5-[[(3-methylphenyl)amino]sulfonyl]benzamide, 2-methyl-N-(6-methylbenzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide
| Molecular Formula | C23H21N3O3S2 |
|---|---|
| Molecular Weight | 451.10 g/mol |
| LogP | 5.27466 |
| Topological Polar Surface Area | 88.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 451.10245 |
| Heavy Atoms | 31 |
| Complexity | 1408.8666 |
Chemical Identifiers
| CAS Number | 852916-98-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)NC3=NC4=C(S3)C=C(C=C4)C |
Product Overview
2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide (CAS 852916-98-4), with molecular formula C23H21N3O3S2 and molecular weight 451.10 g/mol. IUPAC: 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide.
Chemical Property Profile of 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide
Property Insights of 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide
The XLogP value of 5.27466 indicates that 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide. Following Lipinski's Rule of Five, 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide?
The CAS number of 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide is 852916-98-4.
What is the molecular formula of 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide?
The molecular formula of 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide is C23H21N3O3S2.
What is the molecular weight of 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide?
The molecular weight of 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide is 451.10 g/mol.
Where can I buy 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide?
You can request a quote for 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-[(3-methylphenyl)sulfamoyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.