11-(2-Diethylaminoethylimino)-2-methyl-6H-dibenzo(b,e)thiepin dihydrochloride
TL;DR: 11-(2-Diethylaminoethylimino)-2-methyl-6H-dibenzo(b,e)thiepin dihydrochloride (CAS 73150-29-5) is a chemical compound with molecular formula C21H28Cl2N2S and molecular weight 410.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-2-[(2-methyl-6H-benzo[c][1]benzothiepin-11-ylidene)amino]ethanamine;dihydrochloride
Also Known As: 11-(2-Diethylaminoethylimino)-2-methyl-6H-dibenzo(b,e)thiepin dihydrochloride, N,N-Diethyl-N'-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-1,2-ethanediamine 2HCl, 1,2-Ethanediamine, N,N-diethyl-N'-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-, dihydrochloride, N,N-diethyl-2-[(2-methyl-6H-benzo[c][1]benzothiepin-11-ylidene)amino]ethanamine dihydrochloride
| Molecular Formula | C21H28Cl2N2S |
|---|---|
| Molecular Weight | 410.14 g/mol |
| LogP | 5.62352 |
| Topological Polar Surface Area | 15.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 410.13504 |
| Heavy Atoms | 26 |
| Complexity | 742.54095 |
Chemical Identifiers
| CAS Number | 73150-29-5 |
|---|---|
| SMILES | CCN(CC)CCN=C1C2=CC=CC=C2CSC3=C1C=C(C=C3)C.Cl.Cl |
Product Overview
11-(2-Diethylaminoethylimino)-2-methyl-6H-dibenzo(b,e)thiepin dihydrochloride (CAS 73150-29-5), with molecular formula C21H28Cl2N2S and molecular weight 410.14 g/mol. IUPAC: N,N-diethyl-2-[(2-methyl-6H-benzo[c][1]benzothiepin-11-ylidene)amino]ethanamine;dihydrochloride.
Chemical Property Profile of 11-(2-Diethylaminoethylimino)-2-methyl-6H-dibenzo(b,e)thiepin dihydrochloride
Property Insights of 11-(2-Diethylaminoethylimino)-2-methyl-6H-dibenzo(b,e)thiepin dihydrochloride
The XLogP value of 5.62352 indicates that 11-(2-Diethylaminoethylimino)-2-methyl-6H-dibenzo(b,e)thiepin dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.6 Ų, 11-(2-Diethylaminoethylimino)-2-methyl-6H-dibenzo(b,e)thiepin dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11-(2-Diethylaminoethylimino)-2-methyl-6H-dibenzo(b,e)thiepin dihydrochloride has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 11-(2-Diethylaminoethylimino)-2-methyl-6H-dibenzo(b,e)thiepin dihydrochloride?
The CAS number of 11-(2-Diethylaminoethylimino)-2-methyl-6H-dibenzo(b,e)thiepin dihydrochloride is 73150-29-5.
What is the molecular formula of 11-(2-Diethylaminoethylimino)-2-methyl-6H-dibenzo(b,e)thiepin dihydrochloride?
The molecular formula of 11-(2-Diethylaminoethylimino)-2-methyl-6H-dibenzo(b,e)thiepin dihydrochloride is C21H28Cl2N2S.
What is the molecular weight of 11-(2-Diethylaminoethylimino)-2-methyl-6H-dibenzo(b,e)thiepin dihydrochloride?
The molecular weight of 11-(2-Diethylaminoethylimino)-2-methyl-6H-dibenzo(b,e)thiepin dihydrochloride is 410.14 g/mol.
Where can I buy 11-(2-Diethylaminoethylimino)-2-methyl-6H-dibenzo(b,e)thiepin dihydrochloride?
You can request a quote for 11-(2-Diethylaminoethylimino)-2-methyl-6H-dibenzo(b,e)thiepin dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11-(2-Diethylaminoethylimino)-2-methyl-6H-dibenzo(b,e)thiepin dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 11-(2-Diethylaminoethylimino)-2-methyl-6H-dibenzo(b,e)thiepin dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.