2-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
TL;DR: 2-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide (CAS 701229-07-4) is a chemical compound with molecular formula C17H16N2O3S2 and molecular weight 360.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
Also Known As: BAS 09532944, 2-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide, AJ-292/42648670, 2-(benzylsulfonyl)-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide, N-(6-Methyl-benzothiazol-2-yl)-2-phenylmethanesulfonyl-acetamide
| Molecular Formula | C17H16N2O3S2 |
|---|---|
| Molecular Weight | 360.06 g/mol |
| LogP | 3.15822 |
| Topological Polar Surface Area | 76.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 360.06024 |
| Heavy Atoms | 24 |
| Complexity | 979.4981 |
Chemical Identifiers
| CAS Number | 701229-07-4 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(S2)NC(=O)CS(=O)(=O)CC3=CC=CC=C3 |
Product Overview
2-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide (CAS 701229-07-4), with molecular formula C17H16N2O3S2 and molecular weight 360.06 g/mol. IUPAC: 2-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide.
Chemical Property Profile of 2-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
Property Insights of 2-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
The XLogP value of 3.15822 indicates that 2-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide. Following Lipinski's Rule of Five, 2-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide has 1 hydrogen bond donor(s) and 5 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-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide?
The CAS number of 2-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide is 701229-07-4.
What is the molecular formula of 2-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide?
The molecular formula of 2-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide is C17H16N2O3S2.
What is the molecular weight of 2-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide?
The molecular weight of 2-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide is 360.06 g/mol.
Where can I buy 2-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide?
You can request a quote for 2-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-benzylsulfonyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.