![1-(1-Chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine structure](/static/products/107/107165-22-0.png)
1-(1-Chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine
TL;DR: 1-(1-Chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine (CAS 107165-22-0) is a chemical compound with molecular formula C18H19ClN2S and molecular weight 330.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine
Also Known As: AE-641/30152009, 1-(1-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine, 1-(6-chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)piperazine
| Molecular Formula | C18H19ClN2S |
|---|---|
| Molecular Weight | 330.10 g/mol |
| LogP | 3.9936 |
| Topological Polar Surface Area | 15.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 330.09573 |
| Heavy Atoms | 22 |
| Complexity | 682.5374 |
Chemical Identifiers
| CAS Number | 107165-22-0 |
|---|---|
| SMILES | C1CN(CCN1)C2CC3=CC=CC=C3SC4=C2C=CC=C4Cl |
Product Overview
1-(1-Chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine (CAS 107165-22-0), with molecular formula C18H19ClN2S and molecular weight 330.10 g/mol. IUPAC: 1-(1-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine.
Chemical Property Profile of 1-(1-Chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine
Property Insights of 1-(1-Chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine
The XLogP value of 3.9936 indicates that 1-(1-Chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.27 Ų, 1-(1-Chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-Chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine has 1 hydrogen bond donor(s) and 3 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 1-(1-Chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine?
The CAS number of 1-(1-Chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine is 107165-22-0.
What is the molecular formula of 1-(1-Chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine?
The molecular formula of 1-(1-Chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine is C18H19ClN2S.
What is the molecular weight of 1-(1-Chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine?
The molecular weight of 1-(1-Chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine is 330.10 g/mol.
Where can I buy 1-(1-Chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine?
You can request a quote for 1-(1-Chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-Chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-Chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.