![[[Phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate structure](/static/products/332/332945-57-0.png)
[[Phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate
TL;DR: [[Phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate (CAS 332945-57-0) is a chemical compound with molecular formula C19H13N3O4 and molecular weight 347.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate
Also Known As: phenyl(4-pyridinyl)methanone O-{4-nitrobenzoyl}oxime, [[phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate
| Molecular Formula | C19H13N3O4 |
|---|---|
| Molecular Weight | 347.09 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 97.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 347.0906 |
| Heavy Atoms | 26 |
| Complexity | 511.0 |
Chemical Identifiers
| CAS Number | 332945-57-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=NOC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=NC=C3 |
| InChIKey | RAYNBWCXEMCKJN-UHFFFAOYSA-N |
Product Overview
[[Phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate (CAS 332945-57-0), with molecular formula C19H13N3O4 and molecular weight 347.09 g/mol. IUPAC: [[phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate.
Chemical Property Profile of [[Phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate
Property Insights of [[Phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate
The XLogP value of 4.0 indicates that [[Phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.4 Ų falls within the moderate polarity range, balancing permeability and solubility for [[Phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate. Following Lipinski's Rule of Five, [[Phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate has 0 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 [[Phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate?
The CAS number of [[Phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate is 332945-57-0.
What is the molecular formula of [[Phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate?
The molecular formula of [[Phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate is C19H13N3O4.
What is the molecular weight of [[Phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate?
The molecular weight of [[Phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate is 347.09 g/mol.
Where can I buy [[Phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate?
You can request a quote for [[Phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [[Phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [[Phenyl(pyridin-4-yl)methylidene]amino] 4-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.