2-benzoxazol-2-ylthio-N-[4-(methylethyl)phenyl]acetamide
TL;DR: 2-benzoxazol-2-ylthio-N-[4-(methylethyl)phenyl]acetamide (CAS 332129-73-4) is a chemical compound with molecular formula C18H18N2O2S and molecular weight 326.11 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-(4-propan-2-ylphenyl)acetamide
Also Known As: 2-(benzo[d]oxazol-2-ylthio)-N-(4-isopropylphenyl)acetamide, 2-benzoxazol-2-ylthio-N-[4-(methylethyl)phenyl]acetamide, 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(4-propan-2-ylphenyl)acetamide, 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-(propan-2-yl)phenyl]acetamide
| Molecular Formula | C18H18N2O2S |
|---|---|
| Molecular Weight | 326.11 g/mol |
| LogP | 4.682 |
| Topological Polar Surface Area | 55.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 326.1089 |
| Heavy Atoms | 23 |
| Complexity | 776.25946 |
Chemical Identifiers
| CAS Number | 332129-73-4 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3O2 |
Product Overview
2-benzoxazol-2-ylthio-N-[4-(methylethyl)phenyl]acetamide (CAS 332129-73-4), with molecular formula C18H18N2O2S and molecular weight 326.11 g/mol. IUPAC: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(4-propan-2-ylphenyl)acetamide.
Chemical Property Profile of 2-benzoxazol-2-ylthio-N-[4-(methylethyl)phenyl]acetamide
Property Insights of 2-benzoxazol-2-ylthio-N-[4-(methylethyl)phenyl]acetamide
The XLogP value of 4.682 indicates that 2-benzoxazol-2-ylthio-N-[4-(methylethyl)phenyl]acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.13 Ų, 2-benzoxazol-2-ylthio-N-[4-(methylethyl)phenyl]acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-benzoxazol-2-ylthio-N-[4-(methylethyl)phenyl]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-benzoxazol-2-ylthio-N-[4-(methylethyl)phenyl]acetamide?
The CAS number of 2-benzoxazol-2-ylthio-N-[4-(methylethyl)phenyl]acetamide is 332129-73-4.
What is the molecular formula of 2-benzoxazol-2-ylthio-N-[4-(methylethyl)phenyl]acetamide?
The molecular formula of 2-benzoxazol-2-ylthio-N-[4-(methylethyl)phenyl]acetamide is C18H18N2O2S.
What is the molecular weight of 2-benzoxazol-2-ylthio-N-[4-(methylethyl)phenyl]acetamide?
The molecular weight of 2-benzoxazol-2-ylthio-N-[4-(methylethyl)phenyl]acetamide is 326.11 g/mol.
Where can I buy 2-benzoxazol-2-ylthio-N-[4-(methylethyl)phenyl]acetamide?
You can request a quote for 2-benzoxazol-2-ylthio-N-[4-(methylethyl)phenyl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-benzoxazol-2-ylthio-N-[4-(methylethyl)phenyl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-benzoxazol-2-ylthio-N-[4-(methylethyl)phenyl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.