CTK5F4969
TL;DR: CTK5F4969 (CAS 85409-64-9) is a chemical compound with molecular formula C18H18N4O3 and molecular weight 338.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-2-[(1,3,3-trimethylindol-2-ylidene)methyldiazenyl]phenol
Also Known As: EINECS 287-135-0, 2-[[(1,3-DIHYDRO-1,3,3-TRIMETHYL-2H-INDOL-2-YLIDENE)METHYL]AZO]-4-NITROPHENOL, 2-(((1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)methyl)azo)-4-nitrophenol, 2-[2-[(1,3-Dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)methyl]diazenyl]-4-nitrophenol, 4-Nitro-2-{[(1,3,3-trimethyl-1,3-dihydro-2H-indol-2-ylidene)methyl]diazenyl}phenol
| Molecular Formula | C18H18N4O3 |
|---|---|
| Molecular Weight | 338.14 g/mol |
| LogP | 4.6531 |
| Topological Polar Surface Area | 91.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.13788 |
| Heavy Atoms | 25 |
| Complexity | 902.9442 |
Chemical Identifiers
| CAS Number | 85409-64-9 |
|---|---|
| SMILES | CC1(C2=CC=CC=C2N(C1=CN=NC3=C(C=CC(=C3)[N+](=O)[O-])O)C)C |
Product Overview
CTK5F4969 (CAS 85409-64-9), with molecular formula C18H18N4O3 and molecular weight 338.14 g/mol. IUPAC: 4-nitro-2-[(1,3,3-trimethylindol-2-ylidene)methyldiazenyl]phenol.
Chemical Property Profile of CTK5F4969
Property Insights of CTK5F4969
The XLogP value of 4.6531 indicates that CTK5F4969 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.33 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK5F4969. Following Lipinski's Rule of Five, CTK5F4969 has 1 hydrogen bond donor(s) and 6 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 CTK5F4969?
The CAS number of CTK5F4969 is 85409-64-9.
What is the molecular formula of CTK5F4969?
The molecular formula of CTK5F4969 is C18H18N4O3.
What is the molecular weight of CTK5F4969?
The molecular weight of CTK5F4969 is 338.14 g/mol.
Where can I buy CTK5F4969?
You can request a quote for CTK5F4969 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK5F4969?
Yes, KEHONG BIO provides custom synthesis services for CTK5F4969 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.