CTK4H8726
TL;DR: CTK4H8726 (CAS 3773-10-2) is a chemical compound with molecular formula C34H34N2O8S2 and molecular weight 662.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-butyl-2-[[4-(5-butyl-2-sulfoanilino)-9,10-dioxoanthracen-1-yl]amino]benzenesulfonic acid
Also Known As: 2,2'-((9,10-Dihydro-9,10-dioxo-1,4-anthrylene)diimino)bis(5-butylbenzenesulphonic) acid, 2,2'-[(9,10-dioxo-9,10-dihydroanthracene-1,4-diyl)diimino]bis(4-butylbenzenesulfonic acid), 2,2-((9,10-Dihydro-9,10-dioxo-1,4-anthrylene)diimino)bis(5-butylbenzenesulphonic) acid, 4-butyl-2-[[4-(5-butyl-2-sulfoanilino)-9,10-dioxoanthracen-1-yl]amino]benzenesulfonic acid, EINECS 223-222-1
| Molecular Formula | C34H34N2O8S2 |
|---|---|
| Molecular Weight | 662.18 g/mol |
| LogP | 8.3 |
| Topological Polar Surface Area | 184.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Exact Mass | 662.17566 |
| Heavy Atoms | 46 |
| Complexity | 1180.0 |
Chemical Identifiers
| CAS Number | 3773-10-2 |
|---|---|
| SMILES | CCCCC1=CC(=C(C=C1)S(=O)(=O)O)NC2=C3C(=C(C=C2)NC4=C(C=CC(=C4)CCCC)S(=O)(=O)O)C(=O)C5=CC=CC=C5C3=O |
| InChIKey | SMKDEHYKQHEJBM-UHFFFAOYSA-N |
Product Overview
CTK4H8726 (CAS 3773-10-2), with molecular formula C34H34N2O8S2 and molecular weight 662.18 g/mol. IUPAC: 4-butyl-2-[[4-(5-butyl-2-sulfoanilino)-9,10-dioxoanthracen-1-yl]amino]benzenesulfonic acid.
Chemical Property Profile of CTK4H8726
Property Insights of CTK4H8726
The XLogP value of 8.3 indicates that CTK4H8726 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 184.0 Ų indicates high polarity, suggesting CTK4H8726 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CTK4H8726 has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CTK4H8726?
The CAS number of CTK4H8726 is 3773-10-2.
What is the molecular formula of CTK4H8726?
The molecular formula of CTK4H8726 is C34H34N2O8S2.
What is the molecular weight of CTK4H8726?
The molecular weight of CTK4H8726 is 662.18 g/mol.
Where can I buy CTK4H8726?
You can request a quote for CTK4H8726 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK4H8726?
Yes, KEHONG BIO provides custom synthesis services for CTK4H8726 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.