2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-nitrobenzamide
TL;DR: 2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-nitrobenzamide (CAS 335205-67-9) is a chemical compound with molecular formula C21H11ClN2O5 and molecular weight 406.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-nitrobenzamide
Also Known As: BAS 02286416, 2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-nitrobenzamide, 2-chloro-N-(9,10-dioxo-9,10-dihydroanthracen-2-yl)-4-nitrobenzamide, 2-Chloro-N-(9,10-dioxo-9,10-dihydro-anthracen-2-yl)-4-nitro-benzamide
| Molecular Formula | C21H11ClN2O5 |
|---|---|
| Molecular Weight | 406.04 g/mol |
| LogP | 4.2759 |
| Topological Polar Surface Area | 106.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 406.03564 |
| Heavy Atoms | 29 |
| Complexity | 1235.4912 |
Chemical Identifiers
| CAS Number | 335205-67-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl |
Product Overview
2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-nitrobenzamide (CAS 335205-67-9), with molecular formula C21H11ClN2O5 and molecular weight 406.04 g/mol. IUPAC: 2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-nitrobenzamide.
Chemical Property Profile of 2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-nitrobenzamide
Property Insights of 2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-nitrobenzamide
The XLogP value of 4.2759 indicates that 2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-nitrobenzamide. Following Lipinski's Rule of Five, 2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-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 2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-nitrobenzamide?
The CAS number of 2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-nitrobenzamide is 335205-67-9.
What is the molecular formula of 2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-nitrobenzamide?
The molecular formula of 2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-nitrobenzamide is C21H11ClN2O5.
What is the molecular weight of 2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-nitrobenzamide?
The molecular weight of 2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-nitrobenzamide is 406.04 g/mol.
Where can I buy 2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-nitrobenzamide?
You can request a quote for 2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(9,10-dioxoanthracen-2-yl)-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.