Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-N,N-dimethyl-, hydrochloride
TL;DR: Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-N,N-dimethyl-, hydrochloride (CAS 82394-11-4) is a chemical compound with molecular formula C17H20ClNS and molecular weight 305.10 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-ylmethyl(dimethyl)azanium chloride
Also Known As: 11-(Dimethylaminomethyl)-6,11-dihydrodibenzo(b,e)thiepin hydrochloride, 6,11-Dihydro-N,N-dimethyldibenzo(b,e)thiepin-11-methanamine hydrochloride, DIBENZO(b,e)THIEPIN-11-METHANAMINE, 6,11-DIHYDRO-N,N-DIMETHYL-, HYDROCHLORIDE, 6,11-Dihydrobenzo[c][1]benzothiepin-11-ylmethyl(dimethyl)azaniumchloride, 6,11-dihydrobenzo[c][1]benzothiepin-11-ylmethyl(dimethyl)azanium chloride
| Molecular Formula | C17H20ClNS |
|---|---|
| Molecular Weight | 305.10 g/mol |
| LogP | -0.43 |
| Topological Polar Surface Area | 29.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 305.1005 |
| Heavy Atoms | 20 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 82394-11-4 |
|---|---|
| SMILES | C[NH+](C)CC1C2=CC=CC=C2CSC3=CC=CC=C13.[Cl-] |
| InChIKey | NGGLAOUIXGGBFF-UHFFFAOYSA-N |
Product Overview
Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-N,N-dimethyl-, hydrochloride (CAS 82394-11-4), with molecular formula C17H20ClNS and molecular weight 305.10 g/mol. IUPAC: 6,11-dihydrobenzo[c][1]benzothiepin-11-ylmethyl(dimethyl)azanium chloride.
Chemical Property Profile of Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-N,N-dimethyl-, hydrochloride
Property Insights of Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-N,N-dimethyl-, hydrochloride
The XLogP value of -0.43 indicates that Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-N,N-dimethyl-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 29.7 Ų, Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-N,N-dimethyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-N,N-dimethyl-, hydrochloride 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 Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-N,N-dimethyl-, hydrochloride?
The CAS number of Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-N,N-dimethyl-, hydrochloride is 82394-11-4.
What is the molecular formula of Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-N,N-dimethyl-, hydrochloride?
The molecular formula of Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-N,N-dimethyl-, hydrochloride is C17H20ClNS.
What is the molecular weight of Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-N,N-dimethyl-, hydrochloride?
The molecular weight of Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-N,N-dimethyl-, hydrochloride is 305.10 g/mol.
Where can I buy Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-N,N-dimethyl-, hydrochloride?
You can request a quote for Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-N,N-dimethyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-N,N-dimethyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Dibenzo(b,e)thiepin-11-methanamine, 6,11-dihydro-N,N-dimethyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.