![(E)-2-(benzo[d]oxazol-2-ylthio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide structure](/static/products/956/956629-53-1.png)
(E)-2-(benzo[d]oxazol-2-ylthio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide
TL;DR: (E)-2-(benzo[d]oxazol-2-ylthio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide (CAS 956629-53-1) is a chemical compound with molecular formula C21H19N5O2S and molecular weight 405.13 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)-(3,5-dimethyl-1-phenylpyrazol-4-yl)methylideneamino]acetamide
Also Known As: (E)-2-(benzo[d]oxazol-2-ylthio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide, 2-(1,3-benzoxazol-2-ylsulfanyl)-N'-[(E)-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylidene]acetohydrazide, 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(E)-(3,5-dimethyl-1-phenylpyrazol-4-yl)methylideneamino]acetamide, N-[(1E)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-1-azavinyl]-2-benzoxazol-2-ylthi oacetamide
| Molecular Formula | C21H19N5O2S |
|---|---|
| Molecular Weight | 405.13 g/mol |
| LogP | 3.87274 |
| Topological Polar Surface Area | 85.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 405.12595 |
| Heavy Atoms | 29 |
| Complexity | 1147.4849 |
Chemical Identifiers
| CAS Number | 956629-53-1 |
|---|---|
| SMILES | CC1=C(C(=NN1C2=CC=CC=C2)C)/C=N/NC(=O)CSC3=NC4=CC=CC=C4O3 |
Product Overview
(E)-2-(benzo[d]oxazol-2-ylthio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide (CAS 956629-53-1), with molecular formula C21H19N5O2S and molecular weight 405.13 g/mol. IUPAC: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(E)-(3,5-dimethyl-1-phenylpyrazol-4-yl)methylideneamino]acetamide.
Chemical Property Profile of (E)-2-(benzo[d]oxazol-2-ylthio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide
Property Insights of (E)-2-(benzo[d]oxazol-2-ylthio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide
The XLogP value of 3.87274 indicates that (E)-2-(benzo[d]oxazol-2-ylthio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.31 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-(benzo[d]oxazol-2-ylthio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide. Following Lipinski's Rule of Five, (E)-2-(benzo[d]oxazol-2-ylthio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide 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 (E)-2-(benzo[d]oxazol-2-ylthio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide?
The CAS number of (E)-2-(benzo[d]oxazol-2-ylthio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide is 956629-53-1.
What is the molecular formula of (E)-2-(benzo[d]oxazol-2-ylthio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide?
The molecular formula of (E)-2-(benzo[d]oxazol-2-ylthio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide is C21H19N5O2S.
What is the molecular weight of (E)-2-(benzo[d]oxazol-2-ylthio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide?
The molecular weight of (E)-2-(benzo[d]oxazol-2-ylthio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide is 405.13 g/mol.
Where can I buy (E)-2-(benzo[d]oxazol-2-ylthio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide?
You can request a quote for (E)-2-(benzo[d]oxazol-2-ylthio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-(benzo[d]oxazol-2-ylthio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-(benzo[d]oxazol-2-ylthio)-N'-((3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylene)acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.