![6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride structure](/static/products/8239/82394-02-3.webp)
6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride
TL;DR: 6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride (CAS 82394-02-3) is a chemical compound with molecular formula C15H16ClNS and molecular weight 277.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,11-dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride
Also Known As: 6,11-Dihydrodibenzo(b,e)thiepin-11-methanamine hydrochloride, 11-(Aminomethyl)-6,11-dihydrodibenzo(b,e)thiepin hydrochloride, DIBENZO(b,e)THIEPIN-11-METHANAMINE, 6,11-DIHYDRO-, HYDROCHLORIDE, 6,11-dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride
| Molecular Formula | C15H16ClNS |
|---|---|
| Molecular Weight | 277.07 g/mol |
| LogP | -0.33 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 277.06918 |
| Heavy Atoms | 18 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 82394-02-3 |
|---|---|
| SMILES | C1C2=CC=CC=C2C(C3=CC=CC=C3S1)C[NH3+].[Cl-] |
| InChIKey | LLFAICDXHPLYIL-UHFFFAOYSA-N |
Product Overview
6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride (CAS 82394-02-3), with molecular formula C15H16ClNS and molecular weight 277.07 g/mol. IUPAC: 6,11-dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride.
Chemical Property Profile of 6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride
Property Insights of 6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride
The XLogP value of -0.33 indicates that 6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.9 Ų, 6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride has 1 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 6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride?
The CAS number of 6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride is 82394-02-3.
What is the molecular formula of 6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride?
The molecular formula of 6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride is C15H16ClNS.
What is the molecular weight of 6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride?
The molecular weight of 6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride is 277.07 g/mol.
Where can I buy 6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride?
You can request a quote for 6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride?
Yes, KEHONG BIO provides custom synthesis services for 6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethylazanium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.