![[[1-Amino-2-(4-nitrophenyl)ethylidene]amino] benzoate structure](/static/products/7362/73623-31-1.webp)
[[1-Amino-2-(4-nitrophenyl)ethylidene]amino] benzoate
TL;DR: [[1-Amino-2-(4-nitrophenyl)ethylidene]amino] benzoate (CAS 73623-31-1) is a chemical compound with molecular formula C15H13N3O4 and molecular weight 299.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[1-amino-2-(4-nitrophenyl)ethylidene]amino] benzoate
Also Known As: O-Benzoyl-2-(p-nitrophenyl)acetamidoxime, ACETAMIDOXIME, O-BENZOYL-2-(p-NITROPHENYL)-, Benzeneethanimidamide, 2-benzoyl-N-hydroxy-4-nitro-
| Molecular Formula | C15H13N3O4 |
|---|---|
| Molecular Weight | 299.09 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 299.0906 |
| Heavy Atoms | 22 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 73623-31-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)ON=C(CC2=CC=C(C=C2)[N+](=O)[O-])N |
| InChIKey | SPMJDENQLBKKAO-UHFFFAOYSA-N |
Product Overview
[[1-Amino-2-(4-nitrophenyl)ethylidene]amino] benzoate (CAS 73623-31-1), with molecular formula C15H13N3O4 and molecular weight 299.09 g/mol. IUPAC: [[1-amino-2-(4-nitrophenyl)ethylidene]amino] benzoate.
Chemical Property Profile of [[1-Amino-2-(4-nitrophenyl)ethylidene]amino] benzoate
Property Insights of [[1-Amino-2-(4-nitrophenyl)ethylidene]amino] benzoate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [[1-Amino-2-(4-nitrophenyl)ethylidene]amino] benzoate. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [[1-Amino-2-(4-nitrophenyl)ethylidene]amino] benzoate. Following Lipinski's Rule of Five, [[1-Amino-2-(4-nitrophenyl)ethylidene]amino] benzoate has 1 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 [[1-Amino-2-(4-nitrophenyl)ethylidene]amino] benzoate?
The CAS number of [[1-Amino-2-(4-nitrophenyl)ethylidene]amino] benzoate is 73623-31-1.
What is the molecular formula of [[1-Amino-2-(4-nitrophenyl)ethylidene]amino] benzoate?
The molecular formula of [[1-Amino-2-(4-nitrophenyl)ethylidene]amino] benzoate is C15H13N3O4.
What is the molecular weight of [[1-Amino-2-(4-nitrophenyl)ethylidene]amino] benzoate?
The molecular weight of [[1-Amino-2-(4-nitrophenyl)ethylidene]amino] benzoate is 299.09 g/mol.
Where can I buy [[1-Amino-2-(4-nitrophenyl)ethylidene]amino] benzoate?
You can request a quote for [[1-Amino-2-(4-nitrophenyl)ethylidene]amino] benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [[1-Amino-2-(4-nitrophenyl)ethylidene]amino] benzoate?
Yes, KEHONG BIO provides custom synthesis services for [[1-Amino-2-(4-nitrophenyl)ethylidene]amino] benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.