![4-{[(3-Nitrophenyl)methylene]amino}phenyl pivalate structure](/static/products/3314/331460-58-3.webp)
4-{[(3-Nitrophenyl)methylene]amino}phenyl pivalate
TL;DR: 4-{[(3-Nitrophenyl)methylene]amino}phenyl pivalate (CAS 331460-58-3) is a chemical compound with molecular formula C18H18N2O4 and molecular weight 326.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(3-nitrophenyl)methylideneamino]phenyl] 2,2-dimethylpropanoate
Also Known As: 4-{[(3-nitrophenyl)methylene]amino}phenyl pivalate, 4-[(E)-[(3-nitrophenyl)methylidene]amino]phenyl 2,2-dimethylpropanoate, [4-[(3-nitrophenyl)methylideneamino]phenyl] 2,2-dimethylpropanoate, 4-[(E)-[(3-nitrophenyl)methylidene]amino]phenyl2,2-dimethylpropanoate
| Molecular Formula | C18H18N2O4 |
|---|---|
| Molecular Weight | 326.13 g/mol |
| LogP | 4.2969 |
| Topological Polar Surface Area | 81.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.12665 |
| Heavy Atoms | 24 |
| Complexity | 774.35095 |
Chemical Identifiers
| CAS Number | 331460-58-3 |
|---|---|
| SMILES | CC(C)(C)C(=O)OC1=CC=C(C=C1)N=CC2=CC(=CC=C2)[N+](=O)[O-] |
Product Overview
4-{[(3-Nitrophenyl)methylene]amino}phenyl pivalate (CAS 331460-58-3), with molecular formula C18H18N2O4 and molecular weight 326.13 g/mol. IUPAC: [4-[(3-nitrophenyl)methylideneamino]phenyl] 2,2-dimethylpropanoate.
Chemical Property Profile of 4-{[(3-Nitrophenyl)methylene]amino}phenyl pivalate
Property Insights of 4-{[(3-Nitrophenyl)methylene]amino}phenyl pivalate
The XLogP value of 4.2969 indicates that 4-{[(3-Nitrophenyl)methylene]amino}phenyl pivalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[(3-Nitrophenyl)methylene]amino}phenyl pivalate. Following Lipinski's Rule of Five, 4-{[(3-Nitrophenyl)methylene]amino}phenyl pivalate has 0 hydrogen bond donor(s) and 5 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-{[(3-Nitrophenyl)methylene]amino}phenyl pivalate?
The CAS number of 4-{[(3-Nitrophenyl)methylene]amino}phenyl pivalate is 331460-58-3.
What is the molecular formula of 4-{[(3-Nitrophenyl)methylene]amino}phenyl pivalate?
The molecular formula of 4-{[(3-Nitrophenyl)methylene]amino}phenyl pivalate is C18H18N2O4.
What is the molecular weight of 4-{[(3-Nitrophenyl)methylene]amino}phenyl pivalate?
The molecular weight of 4-{[(3-Nitrophenyl)methylene]amino}phenyl pivalate is 326.13 g/mol.
Where can I buy 4-{[(3-Nitrophenyl)methylene]amino}phenyl pivalate?
You can request a quote for 4-{[(3-Nitrophenyl)methylene]amino}phenyl pivalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[(3-Nitrophenyl)methylene]amino}phenyl pivalate?
Yes, KEHONG BIO provides custom synthesis services for 4-{[(3-Nitrophenyl)methylene]amino}phenyl pivalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.