N-(8-methyl-4-oxo-3-phenyl-4H-chromen-2-yl)-3-nitrobenzamide
TL;DR: N-(8-methyl-4-oxo-3-phenyl-4H-chromen-2-yl)-3-nitrobenzamide (CAS 879576-20-2) 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-(8-methyl-4-oxo-3-phenylchromen-2-yl)-3-nitrobenzamide
Also Known As: AB01305622-01, N-(8-methyl-4-oxo-3-phenyl-4H-chromen-2-yl)-3-nitrobenzamide, N-(8-methyl-4-oxo-3-phenylchromen-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 | 1343.0612 |
Chemical Identifiers
| CAS Number | 879576-20-2 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)C(=O)C(=C(O2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4 |
Product Overview
N-(8-methyl-4-oxo-3-phenyl-4H-chromen-2-yl)-3-nitrobenzamide (CAS 879576-20-2), with molecular formula C23H16N2O5 and molecular weight 400.11 g/mol. IUPAC: N-(8-methyl-4-oxo-3-phenylchromen-2-yl)-3-nitrobenzamide.
Chemical Property Profile of N-(8-methyl-4-oxo-3-phenyl-4H-chromen-2-yl)-3-nitrobenzamide
Property Insights of N-(8-methyl-4-oxo-3-phenyl-4H-chromen-2-yl)-3-nitrobenzamide
The XLogP value of 4.92892 indicates that N-(8-methyl-4-oxo-3-phenyl-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-(8-methyl-4-oxo-3-phenyl-4H-chromen-2-yl)-3-nitrobenzamide. Following Lipinski's Rule of Five, N-(8-methyl-4-oxo-3-phenyl-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-(8-methyl-4-oxo-3-phenyl-4H-chromen-2-yl)-3-nitrobenzamide?
The CAS number of N-(8-methyl-4-oxo-3-phenyl-4H-chromen-2-yl)-3-nitrobenzamide is 879576-20-2.
What is the molecular formula of N-(8-methyl-4-oxo-3-phenyl-4H-chromen-2-yl)-3-nitrobenzamide?
The molecular formula of N-(8-methyl-4-oxo-3-phenyl-4H-chromen-2-yl)-3-nitrobenzamide is C23H16N2O5.
What is the molecular weight of N-(8-methyl-4-oxo-3-phenyl-4H-chromen-2-yl)-3-nitrobenzamide?
The molecular weight of N-(8-methyl-4-oxo-3-phenyl-4H-chromen-2-yl)-3-nitrobenzamide is 400.11 g/mol.
Where can I buy N-(8-methyl-4-oxo-3-phenyl-4H-chromen-2-yl)-3-nitrobenzamide?
You can request a quote for N-(8-methyl-4-oxo-3-phenyl-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-(8-methyl-4-oxo-3-phenyl-4H-chromen-2-yl)-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(8-methyl-4-oxo-3-phenyl-4H-chromen-2-yl)-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.