![N-[(1E)-2-(4-pentyloxyphenyl)-1-azavinyl]-2-benzoxazol-2-ylthioacetamide structure](/static/products/351/351332-63-3.png)
N-[(1E)-2-(4-pentyloxyphenyl)-1-azavinyl]-2-benzoxazol-2-ylthioacetamide
TL;DR: N-[(1E)-2-(4-pentyloxyphenyl)-1-azavinyl]-2-benzoxazol-2-ylthioacetamide (CAS 351332-63-3) is a chemical compound with molecular formula C21H23N3O3S and molecular weight 397.15 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-[(E)-(4-pentoxyphenyl)methylideneamino]acetamide
Also Known As: N-[(1E)-2-(4-pentyloxyphenyl)-1-azavinyl]-2-benzoxazol-2-ylthioacetamide, (E)-2-(benzo[d]oxazol-2-ylthio)-N'-(4-(pentyloxy)benzylidene)acetohydrazide, 2-(1,3-benzoxazol-2-ylsulfanyl)-N'-{(E)-[4-(pentyloxy)phenyl]methylidene}acetohydrazide, 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(E)-(4-pentoxyphenyl)methylideneamino]acetamide
| Molecular Formula | C21H23N3O3S |
|---|---|
| Molecular Weight | 397.15 g/mol |
| LogP | 4.6392 |
| Topological Polar Surface Area | 76.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 397.14603 |
| Heavy Atoms | 28 |
| Complexity | 889.05035 |
Chemical Identifiers
| CAS Number | 351332-63-3 |
|---|---|
| SMILES | CCCCCOC1=CC=C(C=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3O2 |
Product Overview
N-[(1E)-2-(4-pentyloxyphenyl)-1-azavinyl]-2-benzoxazol-2-ylthioacetamide (CAS 351332-63-3), with molecular formula C21H23N3O3S and molecular weight 397.15 g/mol. IUPAC: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(E)-(4-pentoxyphenyl)methylideneamino]acetamide.
Chemical Property Profile of N-[(1E)-2-(4-pentyloxyphenyl)-1-azavinyl]-2-benzoxazol-2-ylthioacetamide
Property Insights of N-[(1E)-2-(4-pentyloxyphenyl)-1-azavinyl]-2-benzoxazol-2-ylthioacetamide
The XLogP value of 4.6392 indicates that N-[(1E)-2-(4-pentyloxyphenyl)-1-azavinyl]-2-benzoxazol-2-ylthioacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.72 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(1E)-2-(4-pentyloxyphenyl)-1-azavinyl]-2-benzoxazol-2-ylthioacetamide. Following Lipinski's Rule of Five, N-[(1E)-2-(4-pentyloxyphenyl)-1-azavinyl]-2-benzoxazol-2-ylthioacetamide has 1 hydrogen bond donor(s) and 6 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-[(1E)-2-(4-pentyloxyphenyl)-1-azavinyl]-2-benzoxazol-2-ylthioacetamide?
The CAS number of N-[(1E)-2-(4-pentyloxyphenyl)-1-azavinyl]-2-benzoxazol-2-ylthioacetamide is 351332-63-3.
What is the molecular formula of N-[(1E)-2-(4-pentyloxyphenyl)-1-azavinyl]-2-benzoxazol-2-ylthioacetamide?
The molecular formula of N-[(1E)-2-(4-pentyloxyphenyl)-1-azavinyl]-2-benzoxazol-2-ylthioacetamide is C21H23N3O3S.
What is the molecular weight of N-[(1E)-2-(4-pentyloxyphenyl)-1-azavinyl]-2-benzoxazol-2-ylthioacetamide?
The molecular weight of N-[(1E)-2-(4-pentyloxyphenyl)-1-azavinyl]-2-benzoxazol-2-ylthioacetamide is 397.15 g/mol.
Where can I buy N-[(1E)-2-(4-pentyloxyphenyl)-1-azavinyl]-2-benzoxazol-2-ylthioacetamide?
You can request a quote for N-[(1E)-2-(4-pentyloxyphenyl)-1-azavinyl]-2-benzoxazol-2-ylthioacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(1E)-2-(4-pentyloxyphenyl)-1-azavinyl]-2-benzoxazol-2-ylthioacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(1E)-2-(4-pentyloxyphenyl)-1-azavinyl]-2-benzoxazol-2-ylthioacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.