4-Acetoacetamidoazobenzene
TL;DR: 4-Acetoacetamidoazobenzene (CAS 38659-87-9) is a chemical compound with molecular formula C16H15N3O2 and molecular weight 281.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-oxo-N-(4-phenyldiazenylphenyl)butanamide
Also Known As: 3-oxo-N-{4-[(E)-phenyldiazenyl]phenyl}butanamide, 4-Acetoacetylamino-azobenzol, 3-oxo-N-(4-phenyldiazenylphenyl)butanamide, 4-ACETOACETAMIDOAZOBENZENE, 3-Oxo-n-(4-[(e)-phenyldiazenyl]phenyl)butanamide
| Molecular Formula | C16H15N3O2 |
|---|---|
| Molecular Weight | 281.12 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 70.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 281.11642 |
| Heavy Atoms | 21 |
| Complexity | 381.0 |
Chemical Identifiers
| CAS Number | 38659-87-9 |
|---|---|
| SMILES | CC(=O)CC(=O)NC1=CC=C(C=C1)N=NC2=CC=CC=C2 |
| InChIKey | JKFJIVKAJMBNLH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Acetoacetamidoazobenzene (CAS 38659-87-9), with molecular formula C16H15N3O2 and molecular weight 281.12 g/mol. IUPAC: 3-oxo-N-(4-phenyldiazenylphenyl)butanamide.
Chemical Property Profile of 4-Acetoacetamidoazobenzene
Property Insights of 4-Acetoacetamidoazobenzene
The XLogP value of 3.3 indicates that 4-Acetoacetamidoazobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Acetoacetamidoazobenzene. Following Lipinski's Rule of Five, 4-Acetoacetamidoazobenzene 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 4-Acetoacetamidoazobenzene?
The CAS number of 4-Acetoacetamidoazobenzene is 38659-87-9.
What is the molecular formula of 4-Acetoacetamidoazobenzene?
The molecular formula of 4-Acetoacetamidoazobenzene is C16H15N3O2.
What is the molecular weight of 4-Acetoacetamidoazobenzene?
The molecular weight of 4-Acetoacetamidoazobenzene is 281.12 g/mol.
Where can I buy 4-Acetoacetamidoazobenzene?
You can request a quote for 4-Acetoacetamidoazobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Acetoacetamidoazobenzene?
Yes, KEHONG BIO provides custom synthesis services for 4-Acetoacetamidoazobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.