CTK5F4585
TL;DR: CTK5F4585 (CAS 85223-07-0) is a chemical compound with molecular formula C47H28ClN5O8 and molecular weight 825.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-chloro-2-methoxyphenyl)-N-[4-[[4-[(9,10-dioxoanthracen-1-yl)diazenyl]-3-hydroxynaphthalene-2-carbonyl]amino]phenyl]-1,3-dioxoisoindole-5-carboxamide
Also Known As: EINECS 286-360-1, 2-(5-Chloro-2-methoxyphenyl)-N-(4-(((4-((9,10-dihydro-9,10-dioxo-1-anthryl)azo)-3-hydroxy-2-naphthyl)carbonyl)amino)phenyl)-2,3-dihydro-1,3-dioxo-1H-isoindole-5-carboxamide, 2-(5-CHLORO-2-METHOXYPHENYL)-N-(4-{4-[2-(9,10-DIOXO-9,10-DIHYDROANTHRACEN-1-YL)DIAZEN-1-YL]-3-HYDROXYNAPHTHALENE-2-AMIDO}PHENYL)-1,3-DIOXO-2,3-DIHYDRO-1H-ISOINDOLE-5-CARBOXAMIDE, 2-(5-CHLORO-2-METHOXYPHENYL)-N-[4-[[[4-[(9,10-DIHYDRO-9,10-DIOXO-1-ANTHRYL)AZO]-3-HYDROXY-2-NAPHTHYL]CARBONYL]AMINO]PHENYL]-2,3-DIHYDRO-1,3-DIOXO-1H-ISOINDOLE-5-CARBOXAMIDE, 2-(5-Chloro-2-methoxyphenyl)-N-[4-[[[4-[[(9,10-dihydro-9,10-dioxoanthracen)-1-yl]azo]3-hydroxy-2-naphthalenyl]carbonyl]amino]phenyl]-2,3-dihydro-1,3-dioxo-1H-isoindole-5-carboxamide
| Molecular Formula | C47H28ClN5O8 |
|---|---|
| Molecular Weight | 825.16 g/mol |
| LogP | 9.7034 |
| Topological Polar Surface Area | 183.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 825.16266 |
| Heavy Atoms | 61 |
| Complexity | 3126.2446 |
Chemical Identifiers
| CAS Number | 85223-07-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Cl)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=CC=C(C=C4)NC(=O)C5=CC6=CC=CC=C6C(=C5O)N=NC7=CC=CC8=C7C(=O)C9=CC=CC=C9C8=O |
Product Overview
CTK5F4585 (CAS 85223-07-0), with molecular formula C47H28ClN5O8 and molecular weight 825.16 g/mol. IUPAC: 2-(5-chloro-2-methoxyphenyl)-N-[4-[[4-[(9,10-dioxoanthracen-1-yl)diazenyl]-3-hydroxynaphthalene-2-carbonyl]amino]phenyl]-1,3-dioxoisoindole-5-carboxamide.
Chemical Property Profile of CTK5F4585
Property Insights of CTK5F4585
The XLogP value of 9.7034 indicates that CTK5F4585 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 183.9 Ų indicates high polarity, suggesting CTK5F4585 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CTK5F4585 has 3 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 CTK5F4585?
The CAS number of CTK5F4585 is 85223-07-0.
What is the molecular formula of CTK5F4585?
The molecular formula of CTK5F4585 is C47H28ClN5O8.
What is the molecular weight of CTK5F4585?
The molecular weight of CTK5F4585 is 825.16 g/mol.
Where can I buy CTK5F4585?
You can request a quote for CTK5F4585 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK5F4585?
Yes, KEHONG BIO provides custom synthesis services for CTK5F4585 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.