4-({2-Nitroanilino}carbonyl)phenyl acetate
TL;DR: 4-({2-Nitroanilino}carbonyl)phenyl acetate (CAS 331675-76-4) is a chemical compound with molecular formula C15H12N2O5 and molecular weight 300.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(2-nitrophenyl)carbamoyl]phenyl] acetate
Also Known As: 4-({2-nitroanilino}carbonyl)phenyl acetate, [4-[(2-nitrophenyl)carbamoyl]phenyl] acetate
| Molecular Formula | C15H12N2O5 |
|---|---|
| Molecular Weight | 300.07 g/mol |
| LogP | 2.7724 |
| Topological Polar Surface Area | 98.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.07462 |
| Heavy Atoms | 22 |
| Complexity | 724.9676 |
Chemical Identifiers
| CAS Number | 331675-76-4 |
|---|---|
| SMILES | CC(=O)OC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2[N+](=O)[O-] |
Product Overview
4-({2-Nitroanilino}carbonyl)phenyl acetate (CAS 331675-76-4), with molecular formula C15H12N2O5 and molecular weight 300.07 g/mol. IUPAC: [4-[(2-nitrophenyl)carbamoyl]phenyl] acetate.
Chemical Property Profile of 4-({2-Nitroanilino}carbonyl)phenyl acetate
Property Insights of 4-({2-Nitroanilino}carbonyl)phenyl acetate
The XLogP value of 2.7724 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-({2-Nitroanilino}carbonyl)phenyl acetate. The TPSA of 98.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-({2-Nitroanilino}carbonyl)phenyl acetate. Following Lipinski's Rule of Five, 4-({2-Nitroanilino}carbonyl)phenyl acetate 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 4-({2-Nitroanilino}carbonyl)phenyl acetate?
The CAS number of 4-({2-Nitroanilino}carbonyl)phenyl acetate is 331675-76-4.
What is the molecular formula of 4-({2-Nitroanilino}carbonyl)phenyl acetate?
The molecular formula of 4-({2-Nitroanilino}carbonyl)phenyl acetate is C15H12N2O5.
What is the molecular weight of 4-({2-Nitroanilino}carbonyl)phenyl acetate?
The molecular weight of 4-({2-Nitroanilino}carbonyl)phenyl acetate is 300.07 g/mol.
Where can I buy 4-({2-Nitroanilino}carbonyl)phenyl acetate?
You can request a quote for 4-({2-Nitroanilino}carbonyl)phenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-({2-Nitroanilino}carbonyl)phenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 4-({2-Nitroanilino}carbonyl)phenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.