CTK0H8665
TL;DR: CTK0H8665 (CAS 19545-13-2) is a chemical compound with molecular formula C25H29NO5S and molecular weight 455.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
but-2-enedioic acid;4-(3-methoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-1-methylpiperidine
Also Known As: 8-Methoxy-10-(1-methyl-4-piperidyl)-10,11-dihydrodibenzo(b,f)thiepin hydrogen maleate, 4-(10,11-Dihydro-8-methoxydibenzo(b,f)thiepin-10-yl)-1-methylpiperidine maleate, Piperidine, 4-(10,11-dihydro-8-methoxydibenzo(b,f)thiepin-10-yl)-1-methyl-, maleate (1:1), Piperidine, 4-(10,11-dihydro-8-methoxydibenzo[b,f]thiepin-10-yl)-1-methyl-, maleate (1:1)
| Molecular Formula | C25H29NO5S |
|---|---|
| Molecular Weight | 455.18 g/mol |
| LogP | 4.5397 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 455.17664 |
| Heavy Atoms | 32 |
| Complexity | 528.0 |
Chemical Identifiers
| CAS Number | 19545-13-2 |
|---|---|
| SMILES | CN1CCC(CC1)C2CC3=CC=CC=C3SC4=C2C=C(C=C4)OC.C(=CC(=O)O)C(=O)O |
| InChIKey | WMXNUVIFZPNYMY-UHFFFAOYSA-N |
Product Overview
CTK0H8665 (CAS 19545-13-2), with molecular formula C25H29NO5S and molecular weight 455.18 g/mol. IUPAC: but-2-enedioic acid;4-(3-methoxy-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-1-methylpiperidine.
Chemical Property Profile of CTK0H8665
Property Insights of CTK0H8665
The XLogP value of 4.5397 indicates that CTK0H8665 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK0H8665. Following Lipinski's Rule of Five, CTK0H8665 has 2 hydrogen bond donor(s) and 7 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 CTK0H8665?
The CAS number of CTK0H8665 is 19545-13-2.
What is the molecular formula of CTK0H8665?
The molecular formula of CTK0H8665 is C25H29NO5S.
What is the molecular weight of CTK0H8665?
The molecular weight of CTK0H8665 is 455.18 g/mol.
Where can I buy CTK0H8665?
You can request a quote for CTK0H8665 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK0H8665?
Yes, KEHONG BIO provides custom synthesis services for CTK0H8665 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.