2,4-dichloro-N-((9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl)benzamide
TL;DR: 2,4-dichloro-N-((9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl)benzamide (CAS 799817-38-2) is a chemical compound with molecular formula C22H12Cl2N2O3S and molecular weight 453.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dichloro-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]benzamide
Also Known As: 2,4-dichloro-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]benzamide, 2,4-dichloro-N-[(9,10-dioxoanthracen-2-yl)thiocarbamoyl]benzamide, 2,4-dichloro-N-((9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl)benzamide, 2,4-dichloro-N-[(9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl]benzamide
| Molecular Formula | C22H12Cl2N2O3S |
|---|---|
| Molecular Weight | 453.99 g/mol |
| LogP | 4.8956 |
| Topological Polar Surface Area | 75.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 453.99457 |
| Heavy Atoms | 30 |
| Complexity | 1256.8801 |
Chemical Identifiers
| CAS Number | 799817-38-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)NC(=S)NC(=O)C4=C(C=C(C=C4)Cl)Cl |
Product Overview
2,4-dichloro-N-((9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl)benzamide (CAS 799817-38-2), with molecular formula C22H12Cl2N2O3S and molecular weight 453.99 g/mol. IUPAC: 2,4-dichloro-N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]benzamide.
Chemical Property Profile of 2,4-dichloro-N-((9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl)benzamide
Property Insights of 2,4-dichloro-N-((9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl)benzamide
The XLogP value of 4.8956 indicates that 2,4-dichloro-N-((9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-dichloro-N-((9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl)benzamide. Following Lipinski's Rule of Five, 2,4-dichloro-N-((9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl)benzamide has 2 hydrogen bond donor(s) and 4 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 2,4-dichloro-N-((9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl)benzamide?
The CAS number of 2,4-dichloro-N-((9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl)benzamide is 799817-38-2.
What is the molecular formula of 2,4-dichloro-N-((9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl)benzamide?
The molecular formula of 2,4-dichloro-N-((9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl)benzamide is C22H12Cl2N2O3S.
What is the molecular weight of 2,4-dichloro-N-((9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl)benzamide?
The molecular weight of 2,4-dichloro-N-((9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl)benzamide is 453.99 g/mol.
Where can I buy 2,4-dichloro-N-((9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl)benzamide?
You can request a quote for 2,4-dichloro-N-((9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-dichloro-N-((9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2,4-dichloro-N-((9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.