![[[Amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate structure](/static/products/4156/415694-16-5.webp)
[[Amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate
TL;DR: [[Amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate (CAS 415694-16-5) is a chemical compound with molecular formula C14H10FN3O4 and molecular weight 303.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate
Also Known As: [Imino(3-nitrophenyl)methyl]azanyl 4-fluorobenzoate|[[amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate
| Molecular Formula | C14H10FN3O4 |
|---|---|
| Molecular Weight | 303.07 g/mol |
| LogP | 2.2112 |
| Topological Polar Surface Area | 107.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 303.06552 |
| Heavy Atoms | 22 |
| Complexity | 744.0081 |
Chemical Identifiers
| CAS Number | 415694-16-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C(=NOC(=O)C2=CC=C(C=C2)F)N |
Product Overview
[[Amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate (CAS 415694-16-5), with molecular formula C14H10FN3O4 and molecular weight 303.07 g/mol. IUPAC: [[amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate.
Chemical Property Profile of [[Amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate
Property Insights of [[Amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate
The XLogP value of 2.2112 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [[Amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate. The TPSA of 107.82 Ų falls within the moderate polarity range, balancing permeability and solubility for [[Amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate. Following Lipinski's Rule of Five, [[Amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate 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 [[Amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate?
The CAS number of [[Amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate is 415694-16-5.
What is the molecular formula of [[Amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate?
The molecular formula of [[Amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate is C14H10FN3O4.
What is the molecular weight of [[Amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate?
The molecular weight of [[Amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate is 303.07 g/mol.
Where can I buy [[Amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate?
You can request a quote for [[Amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [[Amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [[Amino-(3-nitrophenyl)methylidene]amino] 4-fluorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.