CTK2H8987
TL;DR: CTK2H8987 (CAS 73150-22-8) is a chemical compound with molecular formula C25H28N2O5S2 and molecular weight 500.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
but-2-enedioic acid;2-(6,11-dihydrobenzo[c][1]benzothiepin-11-ylsulfanyl)-1-(4-methylpiperazin-1-yl)ethanone
Also Known As: 1-(((6,11-Dihydrodibenzo(b,e)thiepin-11-yl)thio)acetyl)-4-methylpiperazine maleate, 11-(4-Methylpiperazinocarbonylmethylthio)-6,11-dihydrodibenzo(b,e)thiepin hydrogen maleate, Piperazine, 1-(((6,11-dihydrodibenzo(b,e)thiepin-11-yl)thio)acetyl)-4-methyl-, (Z)-2-butenedioate (1:1)
| Molecular Formula | C25H28N2O5S2 |
|---|---|
| Molecular Weight | 500.14 g/mol |
| LogP | 3.6007 |
| Topological Polar Surface Area | 98.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 500.14395 |
| Heavy Atoms | 34 |
| Complexity | 987.60645 |
Chemical Identifiers
| CAS Number | 73150-22-8 |
|---|---|
| SMILES | CN1CCN(CC1)C(=O)CSC2C3=CC=CC=C3CSC4=CC=CC=C24.C(=CC(=O)O)C(=O)O |
Product Overview
CTK2H8987 (CAS 73150-22-8), with molecular formula C25H28N2O5S2 and molecular weight 500.14 g/mol. IUPAC: but-2-enedioic acid;2-(6,11-dihydrobenzo[c][1]benzothiepin-11-ylsulfanyl)-1-(4-methylpiperazin-1-yl)ethanone.
Chemical Property Profile of CTK2H8987
Property Insights of CTK2H8987
The XLogP value of 3.6007 indicates that CTK2H8987 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.15 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK2H8987. Following Lipinski's Rule of Five, CTK2H8987 has 2 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 CTK2H8987?
The CAS number of CTK2H8987 is 73150-22-8.
What is the molecular formula of CTK2H8987?
The molecular formula of CTK2H8987 is C25H28N2O5S2.
What is the molecular weight of CTK2H8987?
The molecular weight of CTK2H8987 is 500.14 g/mol.
Where can I buy CTK2H8987?
You can request a quote for CTK2H8987 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK2H8987?
Yes, KEHONG BIO provides custom synthesis services for CTK2H8987 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.