N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(N-methyl-2-phenylethenesulfonamido)acetamide
TL;DR: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(N-methyl-2-phenylethenesulfonamido)acetamide (CAS 872119-01-2) is a chemical compound with molecular formula C18H16FN3O3S2 and molecular weight 405.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-fluoro-1,3-benzothiazol-2-yl)-2-[methyl-[(E)-2-phenylethenyl]sulfonylamino]acetamide
Also Known As: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(N-methyl-2-phenylethenesulfonamido)acetamide, N-(6-fluoro-1,3-benzothiazol-2-yl)-2-[methyl-[(E)-2-phenylethenyl]sulfonylamino]acetamide
| Molecular Formula | C18H16FN3O3S2 |
|---|---|
| Molecular Weight | 405.06 g/mol |
| LogP | 3.3064 |
| Topological Polar Surface Area | 79.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 405.0617 |
| Heavy Atoms | 27 |
| Complexity | 1095.4972 |
Chemical Identifiers
| CAS Number | 872119-01-2 |
|---|---|
| SMILES | CN(CC(=O)NC1=NC2=C(S1)C=C(C=C2)F)S(=O)(=O)/C=C/C3=CC=CC=C3 |
Product Overview
N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(N-methyl-2-phenylethenesulfonamido)acetamide (CAS 872119-01-2), with molecular formula C18H16FN3O3S2 and molecular weight 405.06 g/mol. IUPAC: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-[methyl-[(E)-2-phenylethenyl]sulfonylamino]acetamide.
Chemical Property Profile of N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(N-methyl-2-phenylethenesulfonamido)acetamide
Property Insights of N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(N-methyl-2-phenylethenesulfonamido)acetamide
The XLogP value of 3.3064 indicates that N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(N-methyl-2-phenylethenesulfonamido)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.37 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(N-methyl-2-phenylethenesulfonamido)acetamide. Following Lipinski's Rule of Five, N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(N-methyl-2-phenylethenesulfonamido)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 N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(N-methyl-2-phenylethenesulfonamido)acetamide?
The CAS number of N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(N-methyl-2-phenylethenesulfonamido)acetamide is 872119-01-2.
What is the molecular formula of N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(N-methyl-2-phenylethenesulfonamido)acetamide?
The molecular formula of N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(N-methyl-2-phenylethenesulfonamido)acetamide is C18H16FN3O3S2.
What is the molecular weight of N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(N-methyl-2-phenylethenesulfonamido)acetamide?
The molecular weight of N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(N-methyl-2-phenylethenesulfonamido)acetamide is 405.06 g/mol.
Where can I buy N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(N-methyl-2-phenylethenesulfonamido)acetamide?
You can request a quote for N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(N-methyl-2-phenylethenesulfonamido)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(N-methyl-2-phenylethenesulfonamido)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(N-methyl-2-phenylethenesulfonamido)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.