CTK5B8149
TL;DR: CTK5B8149 (CAS 63217-28-7) is a chemical compound with molecular formula C49H54N4O12S2 and molecular weight 954.318 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-acetamido-3-[[4-[3-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butylcarbamoyl]-4-hydroxynaphthalen-1-yl]oxyphenyl]diazenyl]-4-hydroxynaphthalene-2,7-disulfonic acid
Also Known As: 5-(Acetylamino)-3-((4-((3-(((4-(2,4-bis(tert-pentyl)phenoxy)butyl)amino)carbonyl)-4-hydroxy-1-naphthyl)oxy)phenyl)azo)-4-hydroxynaphthalene-2,7-disulphonic acid, 2,7-Naphthalenedisulfonicacid,5-(acetylamino)-3-[2-[4-[[3-[[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]amino]carbonyl]-4-hydroxy-1-naphthalenyl]oxy]phenyl]diazenyl]-4-hydroxy-, 3-[2-(4-{[3-({4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}carbamoyl)-4-hydroxynaphthalen-1-yl]oxy}phenyl)diazen-1-yl]-5-acetamido-4-hydroxynaphthalene-2,7-disulfonic acid, 3-[4-[[3-[[4-[2,4-Bis(1,1-dimethylpropyl)phenoxy]butyl]carbamoyl]-4-hydroxy-1-naphthyl]oxy]phenylazo]-4-hydroxy-5-(acetylamino)naphthalene-2,7-disulfonic acid, 5-(Acetylamino)-3-[[4-[[3-[[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]amino]carbonyl]-4-hydroxy-1-naphthalenyl]oxy]phenyl]azo]-4-hydroxy-2,7-naphthalenedisulfonic acid
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C49H54N4O12S2 |
| Molecular Weight | 954.318 g/mol |
| XLogP | 10.9 |
| Topological Polar Surface Area (TPSA) | 267.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 18 |
| Exact Mass | 954.318 Da |
| Heavy Atoms | 67 |
| Complexity | 1900.0 |
| SMILES | CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C(C3=CC=CC=C3C(=C2)OC4=CC=C(C=C4)N=NC5=C(C6=C(C=C(C=C6C=C5S(=O)(=O)O)S(=O)(=O)O)NC(=O)C)O)O)C(C)(C)CC |
| InChIKey | NZCVUOKHPIGKMF-UHFFFAOYSA-N |
Chemical Property Profile of CTK5B8149
Property Insights of CTK5B8149
The XLogP value of 10.9 indicates that CTK5B8149 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 267.0 Ų indicates high polarity, suggesting CTK5B8149 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CTK5B8149 has 6 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of CTK5B8149?
The CAS number of CTK5B8149 is 63217-28-7.
What is the molecular formula of CTK5B8149?
The molecular formula of CTK5B8149 is C49H54N4O12S2.
What is the molecular weight of CTK5B8149?
The molecular weight of CTK5B8149 is 954.318 g/mol.
Where can I buy CTK5B8149?
You can request a quote for CTK5B8149 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for CTK5B8149?
Yes, CoreyChem provides custom synthesis services for CTK5B8149 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.