CTK8D6437
TL;DR: CTK8D6437 (CAS 4988-32-3) is a chemical compound with molecular formula C21H15BrN2O5S and molecular weight 485.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-amino-3-bromo-9,10-dioxoanthracen-1-yl)amino]-4-methylbenzenesulfonic acid
Also Known As: 2-[(4-amino-3-bromo-9,10-dioxo-9,10-dihydroanthracen-1-yl)amino]-4-methylbenzenesulfonic acid, 4-((4-Amino-3-bromo-9,10-dihydro-9,10-dioxo-1-anthryl)amino)toluene-3-sulphonic acid, 2-[(4-amino-3-bromo-9,10-dioxoanthracen-1-yl)amino]-4-methylbenzenesulfonic acid, 2-[(4-AMINO-3-BROMO-9,10-DIOXO-9,10-DIHYDROANTHRACEN-1-YL)AMINO]-4-METHYLBENZENE-1-SULFONIC ACID, EINECS 225-647-8
| Molecular Formula | C21H15BrN2O5S |
|---|---|
| Molecular Weight | 485.99 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 485.9885 |
| Heavy Atoms | 30 |
| Complexity | 800.0 |
Chemical Identifiers
| CAS Number | 4988-32-3 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)S(=O)(=O)O)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)Br |
| InChIKey | FSRHFLNKYBSXJZ-UHFFFAOYSA-N |
Product Overview
CTK8D6437 (CAS 4988-32-3), with molecular formula C21H15BrN2O5S and molecular weight 485.99 g/mol. IUPAC: 2-[(4-amino-3-bromo-9,10-dioxoanthracen-1-yl)amino]-4-methylbenzenesulfonic acid.
Chemical Property Profile of CTK8D6437
Property Insights of CTK8D6437
The XLogP value of 4.6 indicates that CTK8D6437 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK8D6437. Following Lipinski's Rule of Five, CTK8D6437 has 3 hydrogen bond donor(s) and 7 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 CTK8D6437?
The CAS number of CTK8D6437 is 4988-32-3.
What is the molecular formula of CTK8D6437?
The molecular formula of CTK8D6437 is C21H15BrN2O5S.
What is the molecular weight of CTK8D6437?
The molecular weight of CTK8D6437 is 485.99 g/mol.
Where can I buy CTK8D6437?
You can request a quote for CTK8D6437 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK8D6437?
Yes, KEHONG BIO provides custom synthesis services for CTK8D6437 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.