4-({2,4-Bisnitrophenyl}hydrazono)-3,3-dimethylbutyl 4-methoxybenzoate
TL;DR: 4-({2,4-Bisnitrophenyl}hydrazono)-3,3-dimethylbutyl 4-methoxybenzoate (CAS 26080-27-3) is a chemical compound with molecular formula C20H22N4O7 and molecular weight 430.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4E)-4-[(2,4-dinitrophenyl)hydrazinylidene]-3,3-dimethylbutyl] 4-methoxybenzoate
Also Known As: 4-({2,4-bisnitrophenyl}hydrazono)-3,3-dimethylbutyl 4-methoxybenzoate, AD-310/37069012, [(4E)-4-[(2,4-dinitrophenyl)hydrazinylidene]-3,3-dimethylbutyl] 4-methoxybenzoate
| Molecular Formula | C20H22N4O7 |
|---|---|
| Molecular Weight | 430.15 g/mol |
| LogP | 4.1826 |
| Topological Polar Surface Area | 146.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 430.14883 |
| Heavy Atoms | 31 |
| Complexity | 987.5229 |
Chemical Identifiers
| CAS Number | 26080-27-3 |
|---|---|
| SMILES | CC(C)(CCOC(=O)C1=CC=C(C=C1)OC)/C=N/NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
4-({2,4-Bisnitrophenyl}hydrazono)-3,3-dimethylbutyl 4-methoxybenzoate (CAS 26080-27-3), with molecular formula C20H22N4O7 and molecular weight 430.15 g/mol. IUPAC: [(4E)-4-[(2,4-dinitrophenyl)hydrazinylidene]-3,3-dimethylbutyl] 4-methoxybenzoate.
Chemical Property Profile of 4-({2,4-Bisnitrophenyl}hydrazono)-3,3-dimethylbutyl 4-methoxybenzoate
Property Insights of 4-({2,4-Bisnitrophenyl}hydrazono)-3,3-dimethylbutyl 4-methoxybenzoate
The XLogP value of 4.1826 indicates that 4-({2,4-Bisnitrophenyl}hydrazono)-3,3-dimethylbutyl 4-methoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 146.2 Ų indicates high polarity, suggesting 4-({2,4-Bisnitrophenyl}hydrazono)-3,3-dimethylbutyl 4-methoxybenzoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-({2,4-Bisnitrophenyl}hydrazono)-3,3-dimethylbutyl 4-methoxybenzoate has 1 hydrogen bond donor(s) and 9 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-({2,4-Bisnitrophenyl}hydrazono)-3,3-dimethylbutyl 4-methoxybenzoate?
The CAS number of 4-({2,4-Bisnitrophenyl}hydrazono)-3,3-dimethylbutyl 4-methoxybenzoate is 26080-27-3.
What is the molecular formula of 4-({2,4-Bisnitrophenyl}hydrazono)-3,3-dimethylbutyl 4-methoxybenzoate?
The molecular formula of 4-({2,4-Bisnitrophenyl}hydrazono)-3,3-dimethylbutyl 4-methoxybenzoate is C20H22N4O7.
What is the molecular weight of 4-({2,4-Bisnitrophenyl}hydrazono)-3,3-dimethylbutyl 4-methoxybenzoate?
The molecular weight of 4-({2,4-Bisnitrophenyl}hydrazono)-3,3-dimethylbutyl 4-methoxybenzoate is 430.15 g/mol.
Where can I buy 4-({2,4-Bisnitrophenyl}hydrazono)-3,3-dimethylbutyl 4-methoxybenzoate?
You can request a quote for 4-({2,4-Bisnitrophenyl}hydrazono)-3,3-dimethylbutyl 4-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-({2,4-Bisnitrophenyl}hydrazono)-3,3-dimethylbutyl 4-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 4-({2,4-Bisnitrophenyl}hydrazono)-3,3-dimethylbutyl 4-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.