2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide
TL;DR: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide (CAS 337502-80-4) is a chemical compound with molecular formula C17H16N2O2S and molecular weight 312.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide
Also Known As: BAS 01355461, 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide, AB00100295-01, 2-benzoxazol-2-ylthio-N-(3,5-dimethylphenyl)acetamide, 2-(Benzooxazol-2-ylsulfanyl)-N-(3,5-dimethyl-phenyl)-acetamide
| Molecular Formula | C17H16N2O2S |
|---|---|
| Molecular Weight | 312.09 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 80.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.09326 |
| Heavy Atoms | 22 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 337502-80-4 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)NC(=O)CSC2=NC3=CC=CC=C3O2)C |
| InChIKey | MVZGQAKDBSWVGZ-UHFFFAOYSA-N |
Product Overview
2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide (CAS 337502-80-4), with molecular formula C17H16N2O2S and molecular weight 312.09 g/mol. IUPAC: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide.
Chemical Property Profile of 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide
Property Insights of 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide
The XLogP value of 4.2 indicates that 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide. Following Lipinski's Rule of Five, 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide has 1 hydrogen bond donor(s) and 4 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-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide?
The CAS number of 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide is 337502-80-4.
What is the molecular formula of 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide?
The molecular formula of 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide is C17H16N2O2S.
What is the molecular weight of 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide?
The molecular weight of 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide is 312.09 g/mol.
Where can I buy 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide?
You can request a quote for 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3,5-dimethylphenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.