CTK5E5300
TL;DR: CTK5E5300 (CAS 78010-22-7) is a chemical compound with molecular formula C40H42N4O2S2 and molecular weight 674.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[[2-[4-(3-phenylprop-2-enyl)piperazine-1-carbonyl]phenyl]disulfanyl]phenyl]-[4-(3-phenylprop-2-enyl)piperazin-1-yl]methanone
Also Known As: 4-(3-Phenylprop-2-enyl)piperazinyl 2-((2-((4-(3-phenylprop-2-enyl)piperazinyl)carbonyl)phenyl)disulfanyl)phenyl ketone, 4-(3-Phenylprop-2-enyl)piperazinyl 2-[(2-{[4-(3-phenylprop-2-enyl)piperazinyl]carbonyl}phenyl)disulfanyl]phenyl ketone
| Molecular Formula | C40H42N4O2S2 |
|---|---|
| Molecular Weight | 674.27 g/mol |
| LogP | 6.8 |
| Topological Polar Surface Area | 97.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 674.2749 |
| Heavy Atoms | 48 |
| Complexity | 960.0 |
Chemical Identifiers
| CAS Number | 78010-22-7 |
|---|---|
| SMILES | C1CN(CCN1CC=CC2=CC=CC=C2)C(=O)C3=CC=CC=C3SSC4=CC=CC=C4C(=O)N5CCN(CC5)CC=CC6=CC=CC=C6 |
| InChIKey | MEVMWMDOFRFJJQ-UHFFFAOYSA-N |
Product Overview
CTK5E5300 (CAS 78010-22-7), with molecular formula C40H42N4O2S2 and molecular weight 674.27 g/mol. IUPAC: [2-[[2-[4-(3-phenylprop-2-enyl)piperazine-1-carbonyl]phenyl]disulfanyl]phenyl]-[4-(3-phenylprop-2-enyl)piperazin-1-yl]methanone.
Chemical Property Profile of CTK5E5300
Property Insights of CTK5E5300
The XLogP value of 6.8 indicates that CTK5E5300 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.7 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK5E5300. Following Lipinski's Rule of Five, CTK5E5300 has 0 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 CTK5E5300?
The CAS number of CTK5E5300 is 78010-22-7.
What is the molecular formula of CTK5E5300?
The molecular formula of CTK5E5300 is C40H42N4O2S2.
What is the molecular weight of CTK5E5300?
The molecular weight of CTK5E5300 is 674.27 g/mol.
Where can I buy CTK5E5300?
You can request a quote for CTK5E5300 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK5E5300?
Yes, KEHONG BIO provides custom synthesis services for CTK5E5300 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.