CTK4F6682
TL;DR: CTK4F6682 (CAS 2589-61-9) is a chemical compound with molecular formula C36H56N2O5S and molecular weight 628.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(1-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carbonyl)amino]-3-[methyl(octadecyl)amino]benzenesulfonic acid
Also Known As: 4-(Methyloctadecylamino)-3-((5,6,7,8-tetrahydro-1-hydroxy-2-naphthyl)carbamoyl)benzenesulphonic acid, 4-{[(1-hydroxy-5,6,7,8-tetrahydronaphthalen-2-yl)carbonyl]amino}-3-[methyl(octadecyl)amino]benzenesulfonic acid, Benzenesulfonic acid, 4-(methyloctadecylamino)-3-(5,6,7,8-tetrahydro-1-hydroxy-2-naphthamido)-, Benzenesulfonic acid,4-(methyloctadecylamino)-3-[[(5,6,7,8-tetrahydro-1-hydroxy-2-naphthalenyl)carbonyl]amino]-, 1-Hydroxy-N-{2-[methyl(octadecyl)amino]-4-sulfophenyl}-5,6,7,8-tetrahydronaphthalene-2-carboximidic acid
| Molecular Formula | C36H56N2O5S |
|---|---|
| Molecular Weight | 628.39 g/mol |
| LogP | 12.0 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 21 |
| Exact Mass | 628.391 |
| Heavy Atoms | 44 |
| Complexity | 893.0 |
Chemical Identifiers
| CAS Number | 2589-61-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCN(C)C1=C(C=CC(=C1)S(=O)(=O)O)NC(=O)C2=C(C3=C(CCCC3)C=C2)O |
| InChIKey | YCETZYXKHCVZDL-UHFFFAOYSA-N |
Product Overview
CTK4F6682 (CAS 2589-61-9), with molecular formula C36H56N2O5S and molecular weight 628.39 g/mol. IUPAC: 4-[(1-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carbonyl)amino]-3-[methyl(octadecyl)amino]benzenesulfonic acid.
Chemical Property Profile of CTK4F6682
Property Insights of CTK4F6682
The XLogP value of 12.0 indicates that CTK4F6682 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK4F6682. Following Lipinski's Rule of Five, CTK4F6682 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CTK4F6682?
The CAS number of CTK4F6682 is 2589-61-9.
What is the molecular formula of CTK4F6682?
The molecular formula of CTK4F6682 is C36H56N2O5S.
What is the molecular weight of CTK4F6682?
The molecular weight of CTK4F6682 is 628.39 g/mol.
Where can I buy CTK4F6682?
You can request a quote for CTK4F6682 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK4F6682?
Yes, KEHONG BIO provides custom synthesis services for CTK4F6682 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.