Piperidine, 4-(dibenzo(b,e)thiepin-6(11H)-ylidene)-1-methyl-, hydrochloride
TL;DR: Piperidine, 4-(dibenzo(b,e)thiepin-6(11H)-ylidene)-1-methyl-, hydrochloride (CAS 1447-70-7) is a chemical compound with molecular formula C20H21NS and molecular weight 307.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(6H-benzo[c][1]benzothiepin-11-ylidene)-1-methylpiperidine
Also Known As: Perithiaden, 4-(dibenzo[b,e]thiepin-11(6h)-ylidene)-1-methylpiperidine, 4-(6H-benzo[c][1]benzothiepin-11-ylidene)-1-methylpiperidine, AE-641/30103008, 4-(Dibenzo(b,e)thiepin-6(11H)-ylidene)-1-methylpiperidine hydrochlorine
| Molecular Formula | C20H21NS |
|---|---|
| Molecular Weight | 307.14 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 28.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 307.13947 |
| Heavy Atoms | 22 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 1447-70-7 |
|---|---|
| SMILES | CN1CCC(=C2C3=CC=CC=C3CSC4=CC=CC=C42)CC1 |
| InChIKey | MBGXTYVKSKOCFX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Piperidine, 4-(dibenzo(b,e)thiepin-6(11H)-ylidene)-1-methyl-, hydrochloride (CAS 1447-70-7), with molecular formula C20H21NS and molecular weight 307.14 g/mol. IUPAC: 4-(6H-benzo[c][1]benzothiepin-11-ylidene)-1-methylpiperidine.
Chemical Property Profile of Piperidine, 4-(dibenzo(b,e)thiepin-6(11H)-ylidene)-1-methyl-, hydrochloride
Property Insights of Piperidine, 4-(dibenzo(b,e)thiepin-6(11H)-ylidene)-1-methyl-, hydrochloride
The XLogP value of 4.1 indicates that Piperidine, 4-(dibenzo(b,e)thiepin-6(11H)-ylidene)-1-methyl-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.5 Ų, Piperidine, 4-(dibenzo(b,e)thiepin-6(11H)-ylidene)-1-methyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperidine, 4-(dibenzo(b,e)thiepin-6(11H)-ylidene)-1-methyl-, hydrochloride has 0 hydrogen bond donor(s) and 2 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 Piperidine, 4-(dibenzo(b,e)thiepin-6(11H)-ylidene)-1-methyl-, hydrochloride?
The CAS number of Piperidine, 4-(dibenzo(b,e)thiepin-6(11H)-ylidene)-1-methyl-, hydrochloride is 1447-70-7.
What is the molecular formula of Piperidine, 4-(dibenzo(b,e)thiepin-6(11H)-ylidene)-1-methyl-, hydrochloride?
The molecular formula of Piperidine, 4-(dibenzo(b,e)thiepin-6(11H)-ylidene)-1-methyl-, hydrochloride is C20H21NS.
What is the molecular weight of Piperidine, 4-(dibenzo(b,e)thiepin-6(11H)-ylidene)-1-methyl-, hydrochloride?
The molecular weight of Piperidine, 4-(dibenzo(b,e)thiepin-6(11H)-ylidene)-1-methyl-, hydrochloride is 307.14 g/mol.
Where can I buy Piperidine, 4-(dibenzo(b,e)thiepin-6(11H)-ylidene)-1-methyl-, hydrochloride?
You can request a quote for Piperidine, 4-(dibenzo(b,e)thiepin-6(11H)-ylidene)-1-methyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperidine, 4-(dibenzo(b,e)thiepin-6(11H)-ylidene)-1-methyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Piperidine, 4-(dibenzo(b,e)thiepin-6(11H)-ylidene)-1-methyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.