3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate
TL;DR: 3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate (CAS 875192-31-7) is a chemical compound with molecular formula C25H25N3O3 and molecular weight 415.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate
Also Known As: 3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate, 3-phenylpropyl 3-[(4-phenyldiazenylphenyl)carbamoyl]propanoate, Butanoic acid, 4-oxo-4-[[4-(2-phenyldiazenyl)phenyl]amino]-, 3-phenylpropyl ester
| Molecular Formula | C25H25N3O3 |
|---|---|
| Molecular Weight | 415.19 g/mol |
| LogP | 5.9967 |
| Topological Polar Surface Area | 80.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 415.1896 |
| Heavy Atoms | 31 |
| Complexity | 987.5404 |
Chemical Identifiers
| CAS Number | 875192-31-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCCOC(=O)CCC(=O)NC2=CC=C(C=C2)N=NC3=CC=CC=C3 |
Product Overview
3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate (CAS 875192-31-7), with molecular formula C25H25N3O3 and molecular weight 415.19 g/mol. IUPAC: 3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate.
Chemical Property Profile of 3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate
Property Insights of 3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate
The XLogP value of 5.9967 indicates that 3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate. Following Lipinski's Rule of Five, 3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate?
The CAS number of 3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate is 875192-31-7.
What is the molecular formula of 3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate?
The molecular formula of 3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate is C25H25N3O3.
What is the molecular weight of 3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate?
The molecular weight of 3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate is 415.19 g/mol.
Where can I buy 3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate?
You can request a quote for 3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate?
Yes, KEHONG BIO provides custom synthesis services for 3-phenylpropyl 4-oxo-4-(4-phenyldiazenylanilino)butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.