RefChem:1100077
TL;DR: RefChem:1100077 (CAS 15930-98-0) is a chemical compound with molecular formula C20H24ClNS and molecular weight 345.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3Z)-3-(2-ethylthioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine;hydrochloride
Also Known As: C20H23NS.ClH.1/2H2O, C20-H23-N-S.Cl-H.1/2H2-O, cis-N,N-Dimethyl-2-ethylthioxanthene-delta(sup 9,gamma)-propylamine hydrochloride H2O (2:2:1), Thioxanthene-delta(sup 9,gamma)-propylamine, N,N-dimethyl-2-ethyl-, hydrochloride, hydrate, (Z)-, (2:2:1), (3Z)-3-(2-ethylthioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine hydrochloride
| Molecular Formula | C20H24ClNS |
|---|---|
| Molecular Weight | 345.13 g/mol |
| LogP | 5.5188 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 345.1318 |
| Heavy Atoms | 23 |
| Complexity | 706.5379 |
Chemical Identifiers
| CAS Number | 15930-98-0 |
|---|---|
| SMILES | CCC1=CC\2=C(C=C1)SC3=CC=CC=C3/C2=C/CCN(C)C.Cl |
Product Overview
RefChem:1100077 (CAS 15930-98-0), with molecular formula C20H24ClNS and molecular weight 345.13 g/mol. IUPAC: (3Z)-3-(2-ethylthioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine;hydrochloride.
Chemical Property Profile of RefChem:1100077
Property Insights of RefChem:1100077
The XLogP value of 5.5188 indicates that RefChem:1100077 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.24 Ų, RefChem:1100077 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1100077 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1100077?
The CAS number of RefChem:1100077 is 15930-98-0.
What is the molecular formula of RefChem:1100077?
The molecular formula of RefChem:1100077 is C20H24ClNS.
What is the molecular weight of RefChem:1100077?
The molecular weight of RefChem:1100077 is 345.13 g/mol.
Where can I buy RefChem:1100077?
You can request a quote for RefChem:1100077 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1100077?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1100077 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.