CTK4D6986
TL;DR: CTK4D6986 (CAS 178979-00-5) is a chemical compound with molecular formula C16H22N4S and molecular weight 302.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(3,5-dimethylphenyl)sulfanyl-1-methyl-4-propan-2-ylimidazol-2-yl]methylidenehydrazine
Also Known As: 5-(3,5-Dimethylphenylthio)-4-isopropyl-1-methyl-1H-imidazole-2-carbaldehyde hydrazone, 5-(3,5-DIMETHYLPHENYLTHIO)-4-ISOPROPYL-1-METHYL-1H-IMIDAZOLE-2-CARBALDEHYDEHYDRAZONE
| Molecular Formula | C16H22N4S |
|---|---|
| Molecular Weight | 302.16 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 81.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.15652 |
| Heavy Atoms | 21 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 178979-00-5 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)SC2=C(N=C(N2C)C=NN)C(C)C)C |
| InChIKey | DBAKFQDBAZTULW-UHFFFAOYSA-N |
Product Overview
CTK4D6986 (CAS 178979-00-5), with molecular formula C16H22N4S and molecular weight 302.16 g/mol. IUPAC: [5-(3,5-dimethylphenyl)sulfanyl-1-methyl-4-propan-2-ylimidazol-2-yl]methylidenehydrazine.
Chemical Property Profile of CTK4D6986
Property Insights of CTK4D6986
The XLogP value of 4.0 indicates that CTK4D6986 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.5 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK4D6986. Following Lipinski's Rule of Five, CTK4D6986 has 1 hydrogen bond donor(s) and 4 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 CTK4D6986?
The CAS number of CTK4D6986 is 178979-00-5.
What is the molecular formula of CTK4D6986?
The molecular formula of CTK4D6986 is C16H22N4S.
What is the molecular weight of CTK4D6986?
The molecular weight of CTK4D6986 is 302.16 g/mol.
Where can I buy CTK4D6986?
You can request a quote for CTK4D6986 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK4D6986?
Yes, KEHONG BIO provides custom synthesis services for CTK4D6986 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.