![N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide structure](/static/products/879/879451-67-9.png)
N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide
TL;DR: N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide (CAS 879451-67-9) is a chemical compound with molecular formula C23H16N2O5 and molecular weight 400.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(4-methylphenyl)-4-oxochromen-2-yl]-3-nitrobenzamide
Also Known As: AB01280512-01, 3-nitro-N-(4-oxo-3-(p-tolyl)-4H-chromen-2-yl)benzamide, N-[3-(4-methylphenyl)-4-oxochromen-2-yl]-3-nitrobenzamide, N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide
| Molecular Formula | C23H16N2O5 |
|---|---|
| Molecular Weight | 400.11 g/mol |
| LogP | 4.92892 |
| Topological Polar Surface Area | 102.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.10593 |
| Heavy Atoms | 30 |
| Complexity | 1340.0612 |
Chemical Identifiers
| CAS Number | 879451-67-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=C(OC3=CC=CC=C3C2=O)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-] |
Product Overview
N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide (CAS 879451-67-9), with molecular formula C23H16N2O5 and molecular weight 400.11 g/mol. IUPAC: N-[3-(4-methylphenyl)-4-oxochromen-2-yl]-3-nitrobenzamide.
Chemical Property Profile of N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide
Property Insights of N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide
The XLogP value of 4.92892 indicates that N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.45 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide. Following Lipinski's Rule of Five, N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide 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 N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide?
The CAS number of N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide is 879451-67-9.
What is the molecular formula of N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide?
The molecular formula of N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide is C23H16N2O5.
What is the molecular weight of N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide?
The molecular weight of N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide is 400.11 g/mol.
Where can I buy N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide?
You can request a quote for N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-(4-methylphenyl)-4-oxo-4H-chromen-2-yl]-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.