2-chloro-N-(9,10-dioxoanthracen-1-yl)-4,5-difluorobenzamide
TL;DR: 2-chloro-N-(9,10-dioxoanthracen-1-yl)-4,5-difluorobenzamide (CAS 438463-99-1) is a chemical compound with molecular formula C21H10ClF2NO3 and molecular weight 397.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(9,10-dioxoanthracen-1-yl)-4,5-difluorobenzamide
Also Known As: 2-chloro-N-(9,10-dioxoanthracen-1-yl)-4,5-difluorobenzamide, 2-chloro-N-(9,10-dioxo-9,10-dihydro-1-anthracenyl)-4,5-difluorobenzamide, 2-chloro-N-(9,10-dioxo-9,10-dihydroanthracen-1-yl)-4,5-difluorobenzamide
| Molecular Formula | C21H10ClF2NO3 |
|---|---|
| Molecular Weight | 397.03 g/mol |
| LogP | 4.6459 |
| Topological Polar Surface Area | 63.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 397.03174 |
| Heavy Atoms | 28 |
| Complexity | 1190.2634 |
Chemical Identifiers
| CAS Number | 438463-99-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NC(=O)C4=CC(=C(C=C4Cl)F)F |
Product Overview
2-chloro-N-(9,10-dioxoanthracen-1-yl)-4,5-difluorobenzamide (CAS 438463-99-1), with molecular formula C21H10ClF2NO3 and molecular weight 397.03 g/mol. IUPAC: 2-chloro-N-(9,10-dioxoanthracen-1-yl)-4,5-difluorobenzamide.
Chemical Property Profile of 2-chloro-N-(9,10-dioxoanthracen-1-yl)-4,5-difluorobenzamide
Property Insights of 2-chloro-N-(9,10-dioxoanthracen-1-yl)-4,5-difluorobenzamide
The XLogP value of 4.6459 indicates that 2-chloro-N-(9,10-dioxoanthracen-1-yl)-4,5-difluorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N-(9,10-dioxoanthracen-1-yl)-4,5-difluorobenzamide. Following Lipinski's Rule of Five, 2-chloro-N-(9,10-dioxoanthracen-1-yl)-4,5-difluorobenzamide has 1 hydrogen bond donor(s) and 3 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-1-yl)-4,5-difluorobenzamide?
The CAS number of 2-chloro-N-(9,10-dioxoanthracen-1-yl)-4,5-difluorobenzamide is 438463-99-1.
What is the molecular formula of 2-chloro-N-(9,10-dioxoanthracen-1-yl)-4,5-difluorobenzamide?
The molecular formula of 2-chloro-N-(9,10-dioxoanthracen-1-yl)-4,5-difluorobenzamide is C21H10ClF2NO3.
What is the molecular weight of 2-chloro-N-(9,10-dioxoanthracen-1-yl)-4,5-difluorobenzamide?
The molecular weight of 2-chloro-N-(9,10-dioxoanthracen-1-yl)-4,5-difluorobenzamide is 397.03 g/mol.
Where can I buy 2-chloro-N-(9,10-dioxoanthracen-1-yl)-4,5-difluorobenzamide?
You can request a quote for 2-chloro-N-(9,10-dioxoanthracen-1-yl)-4,5-difluorobenzamide 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-1-yl)-4,5-difluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(9,10-dioxoanthracen-1-yl)-4,5-difluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.