4-(2-Chlorodibenzo(bf)(1,4)thiazepin-11-yl)piperazine
TL;DR: 4-(2-Chlorodibenzo(bf)(1,4)thiazepin-11-yl)piperazine (CAS 5747-63-7) is a chemical compound with molecular formula C17H16ClN3S and molecular weight 329.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-chloro-6-piperazin-1-ylbenzo[b][1,4]benzothiazepine
Also Known As: 4-Cbtp, 4-(2-Chlorodibenzo(bf)(1,4)thiazepin-11-yl)piperazine, 8-chloro-6-piperazin-1-ylbenzo[b][1,4]benzothiazepine, 11-Piperazino-2-dichlordibenzo<-1,4-thiazepin, Dibenzo(b,f)(1,4)thiazepine, 2-chloro-11-(1-piperazinyl)-
| Molecular Formula | C17H16ClN3S |
|---|---|
| Molecular Weight | 329.08 g/mol |
| LogP | 3.7881 |
| Topological Polar Surface Area | 27.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 329.07535 |
| Heavy Atoms | 22 |
| Complexity | 738.43396 |
Chemical Identifiers
| CAS Number | 5747-63-7 |
|---|---|
| SMILES | C1CN(CCN1)C2=NC3=CC=CC=C3SC4=C2C=C(C=C4)Cl |
Product Overview
4-(2-Chlorodibenzo(bf)(1,4)thiazepin-11-yl)piperazine (CAS 5747-63-7), with molecular formula C17H16ClN3S and molecular weight 329.08 g/mol. IUPAC: 8-chloro-6-piperazin-1-ylbenzo[b][1,4]benzothiazepine.
Chemical Property Profile of 4-(2-Chlorodibenzo(bf)(1,4)thiazepin-11-yl)piperazine
Property Insights of 4-(2-Chlorodibenzo(bf)(1,4)thiazepin-11-yl)piperazine
The XLogP value of 3.7881 indicates that 4-(2-Chlorodibenzo(bf)(1,4)thiazepin-11-yl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.63 Ų, 4-(2-Chlorodibenzo(bf)(1,4)thiazepin-11-yl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-Chlorodibenzo(bf)(1,4)thiazepin-11-yl)piperazine 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 4-(2-Chlorodibenzo(bf)(1,4)thiazepin-11-yl)piperazine?
The CAS number of 4-(2-Chlorodibenzo(bf)(1,4)thiazepin-11-yl)piperazine is 5747-63-7.
What is the molecular formula of 4-(2-Chlorodibenzo(bf)(1,4)thiazepin-11-yl)piperazine?
The molecular formula of 4-(2-Chlorodibenzo(bf)(1,4)thiazepin-11-yl)piperazine is C17H16ClN3S.
What is the molecular weight of 4-(2-Chlorodibenzo(bf)(1,4)thiazepin-11-yl)piperazine?
The molecular weight of 4-(2-Chlorodibenzo(bf)(1,4)thiazepin-11-yl)piperazine is 329.08 g/mol.
Where can I buy 4-(2-Chlorodibenzo(bf)(1,4)thiazepin-11-yl)piperazine?
You can request a quote for 4-(2-Chlorodibenzo(bf)(1,4)thiazepin-11-yl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Chlorodibenzo(bf)(1,4)thiazepin-11-yl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Chlorodibenzo(bf)(1,4)thiazepin-11-yl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.