Bisulepin hydrochloride, (Z)-
TL;DR: Bisulepin hydrochloride, (Z)- (CAS 42505-76-0) is a chemical compound with molecular formula C17H20ClNS2 and molecular weight 337.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3Z)-N,N-dimethyl-3-(5H-thieno[2,3-c][2]benzothiepin-10-ylidene)propan-1-amine;hydrochloride
Also Known As: Dithiadene, cis-Dithiaden hydrochloride, Bisulepin hydrochloride, (Z)-, DITHIADEN HYDROCHLORIDE, (Z)-, 1-Propanamine, N,N-dimethyl-3-thieno(2,3-c)(2)benzothiepin-4(9H)-ylidene-, hydrochloride, (Z)-
| Molecular Formula | C17H20ClNS2 |
|---|---|
| Molecular Weight | 337.07 g/mol |
| LogP | 5.159 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 337.07257 |
| Heavy Atoms | 21 |
| Complexity | 631.2253 |
Chemical Identifiers
| CAS Number | 42505-76-0 |
|---|---|
| SMILES | CN(C)CC/C=C/1\C2=C(SCC3=CC=CC=C31)SC=C2.Cl |
Product Overview
Bisulepin hydrochloride, (Z)- (CAS 42505-76-0), with molecular formula C17H20ClNS2 and molecular weight 337.07 g/mol. IUPAC: (3Z)-N,N-dimethyl-3-(5H-thieno[2,3-c][2]benzothiepin-10-ylidene)propan-1-amine;hydrochloride.
Chemical Property Profile of Bisulepin hydrochloride, (Z)-
Property Insights of Bisulepin hydrochloride, (Z)-
The XLogP value of 5.159 indicates that Bisulepin hydrochloride, (Z)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.24 Ų, Bisulepin hydrochloride, (Z)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bisulepin hydrochloride, (Z)- 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 Bisulepin hydrochloride, (Z)-?
The CAS number of Bisulepin hydrochloride, (Z)- is 42505-76-0.
What is the molecular formula of Bisulepin hydrochloride, (Z)-?
The molecular formula of Bisulepin hydrochloride, (Z)- is C17H20ClNS2.
What is the molecular weight of Bisulepin hydrochloride, (Z)-?
The molecular weight of Bisulepin hydrochloride, (Z)- is 337.07 g/mol.
Where can I buy Bisulepin hydrochloride, (Z)-?
You can request a quote for Bisulepin hydrochloride, (Z)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bisulepin hydrochloride, (Z)-?
Yes, KEHONG BIO provides custom synthesis services for Bisulepin hydrochloride, (Z)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.