Acetamide, 2-(2-benzothiazolylthio)-N-benzoylmethyl-
TL;DR: Acetamide, 2-(2-benzothiazolylthio)-N-benzoylmethyl- (CAS 61078-52-2) is a chemical compound with molecular formula C17H14N2O2S2 and molecular weight 342.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-ylsulfanyl)-N-phenacylacetamide
Also Known As: BAS 00790330, BIM-0030498.P001, Acetamide, 2-(2-benzothiazolylthio)-N-benzoylmethyl-, 2-(1,3-benzothiazol-2-ylsulfanyl)-N-phenacylacetamide, 2-(1,3-benzothiazol-2-ylthio)-N-(2-oxo-2-phenylethyl)acetamide
| Molecular Formula | C17H14N2O2S2 |
|---|---|
| Molecular Weight | 342.05 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 342.04968 |
| Heavy Atoms | 23 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 61078-52-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)CNC(=O)CSC2=NC3=CC=CC=C3S2 |
| InChIKey | JUASEWSUPVWVNK-UHFFFAOYSA-N |
Product Overview
Acetamide, 2-(2-benzothiazolylthio)-N-benzoylmethyl- (CAS 61078-52-2), with molecular formula C17H14N2O2S2 and molecular weight 342.05 g/mol. IUPAC: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-phenacylacetamide.
Chemical Property Profile of Acetamide, 2-(2-benzothiazolylthio)-N-benzoylmethyl-
Property Insights of Acetamide, 2-(2-benzothiazolylthio)-N-benzoylmethyl-
The XLogP value of 4.0 indicates that Acetamide, 2-(2-benzothiazolylthio)-N-benzoylmethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetamide, 2-(2-benzothiazolylthio)-N-benzoylmethyl-. Following Lipinski's Rule of Five, Acetamide, 2-(2-benzothiazolylthio)-N-benzoylmethyl- 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 Acetamide, 2-(2-benzothiazolylthio)-N-benzoylmethyl-?
The CAS number of Acetamide, 2-(2-benzothiazolylthio)-N-benzoylmethyl- is 61078-52-2.
What is the molecular formula of Acetamide, 2-(2-benzothiazolylthio)-N-benzoylmethyl-?
The molecular formula of Acetamide, 2-(2-benzothiazolylthio)-N-benzoylmethyl- is C17H14N2O2S2.
What is the molecular weight of Acetamide, 2-(2-benzothiazolylthio)-N-benzoylmethyl-?
The molecular weight of Acetamide, 2-(2-benzothiazolylthio)-N-benzoylmethyl- is 342.05 g/mol.
Where can I buy Acetamide, 2-(2-benzothiazolylthio)-N-benzoylmethyl-?
You can request a quote for Acetamide, 2-(2-benzothiazolylthio)-N-benzoylmethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetamide, 2-(2-benzothiazolylthio)-N-benzoylmethyl-?
Yes, KEHONG BIO provides custom synthesis services for Acetamide, 2-(2-benzothiazolylthio)-N-benzoylmethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.