N-(9,10-dioxoanthracen-2-yl)-4-methoxy-3-nitrobenzamide
TL;DR: N-(9,10-dioxoanthracen-2-yl)-4-methoxy-3-nitrobenzamide (CAS 335205-63-5) is a chemical compound with molecular formula C22H14N2O6 and molecular weight 402.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(9,10-dioxoanthracen-2-yl)-4-methoxy-3-nitrobenzamide
Also Known As: BAS 02286188, N-(9,10-dioxoanthracen-2-yl)-4-methoxy-3-nitrobenzamide, N-(9,10-dioxo-9,10-dihydroanthracen-2-yl)-3-nitro-4-methoxybenzamide, N-(9,10-dioxo(2-anthryl))(4-methoxy-3-nitrophenyl)carboxamide, N-(9,10-Dioxo-9,10-dihydro-anthracen-2-yl)-4-methoxy-3-nitro-benzamide
| Molecular Formula | C22H14N2O6 |
|---|---|
| Molecular Weight | 402.09 g/mol |
| LogP | 3.6311 |
| Topological Polar Surface Area | 115.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.08517 |
| Heavy Atoms | 30 |
| Complexity | 1248.1252 |
Chemical Identifiers
| CAS Number | 335205-63-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O)[N+](=O)[O-] |
Product Overview
N-(9,10-dioxoanthracen-2-yl)-4-methoxy-3-nitrobenzamide (CAS 335205-63-5), with molecular formula C22H14N2O6 and molecular weight 402.09 g/mol. IUPAC: N-(9,10-dioxoanthracen-2-yl)-4-methoxy-3-nitrobenzamide.
Chemical Property Profile of N-(9,10-dioxoanthracen-2-yl)-4-methoxy-3-nitrobenzamide
Property Insights of N-(9,10-dioxoanthracen-2-yl)-4-methoxy-3-nitrobenzamide
The XLogP value of 3.6311 indicates that N-(9,10-dioxoanthracen-2-yl)-4-methoxy-3-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.61 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(9,10-dioxoanthracen-2-yl)-4-methoxy-3-nitrobenzamide. Following Lipinski's Rule of Five, N-(9,10-dioxoanthracen-2-yl)-4-methoxy-3-nitrobenzamide has 1 hydrogen bond donor(s) and 6 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-(9,10-dioxoanthracen-2-yl)-4-methoxy-3-nitrobenzamide?
The CAS number of N-(9,10-dioxoanthracen-2-yl)-4-methoxy-3-nitrobenzamide is 335205-63-5.
What is the molecular formula of N-(9,10-dioxoanthracen-2-yl)-4-methoxy-3-nitrobenzamide?
The molecular formula of N-(9,10-dioxoanthracen-2-yl)-4-methoxy-3-nitrobenzamide is C22H14N2O6.
What is the molecular weight of N-(9,10-dioxoanthracen-2-yl)-4-methoxy-3-nitrobenzamide?
The molecular weight of N-(9,10-dioxoanthracen-2-yl)-4-methoxy-3-nitrobenzamide is 402.09 g/mol.
Where can I buy N-(9,10-dioxoanthracen-2-yl)-4-methoxy-3-nitrobenzamide?
You can request a quote for N-(9,10-dioxoanthracen-2-yl)-4-methoxy-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-(9,10-dioxoanthracen-2-yl)-4-methoxy-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(9,10-dioxoanthracen-2-yl)-4-methoxy-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.