2'-(3-Dimethylaminopropylthio) cinnamanilide hydrochloride
TL;DR: 2'-(3-Dimethylaminopropylthio) cinnamanilide hydrochloride (CAS 54-84-2) is a chemical compound with molecular formula C20H25ClN2OS and molecular weight 376.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[3-(dimethylamino)propylsulfanyl]phenyl]-3-phenylprop-2-enamide;hydrochloride
Also Known As: Cinanserin hydrochloride, DPTC, Cinanserin (hydrochloride), 2'-(3-DIMETHYLAMINOPROPYL-THIO)-CINNAMANILIDE, N-(2-((3-(Dimethylamino)propyl)thio)phenyl)-3-phenylacrylamide hydrochloride
| Molecular Formula | C20H25ClN2OS |
|---|---|
| Molecular Weight | 376.14 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 376.1376 |
| Heavy Atoms | 25 |
| Complexity | 391.0 |
Chemical Identifiers
| CAS Number | 54-84-2 |
|---|---|
| SMILES | CN(C)CCCSC1=CC=CC=C1NC(=O)C=CC2=CC=CC=C2.Cl |
| InChIKey | LXGJPDKYMJJWRB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2'-(3-Dimethylaminopropylthio) cinnamanilide hydrochloride (CAS 54-84-2), with molecular formula C20H25ClN2OS and molecular weight 376.14 g/mol. IUPAC: N-[2-[3-(dimethylamino)propylsulfanyl]phenyl]-3-phenylprop-2-enamide;hydrochloride.
Chemical Property Profile of 2'-(3-Dimethylaminopropylthio) cinnamanilide hydrochloride
Property Insights of 2'-(3-Dimethylaminopropylthio) cinnamanilide hydrochloride
The XLogP value of 4.8 indicates that 2'-(3-Dimethylaminopropylthio) cinnamanilide hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.6 Ų, 2'-(3-Dimethylaminopropylthio) cinnamanilide hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2'-(3-Dimethylaminopropylthio) cinnamanilide hydrochloride has 2 hydrogen bond donor(s) and 3 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 2'-(3-Dimethylaminopropylthio) cinnamanilide hydrochloride?
The CAS number of 2'-(3-Dimethylaminopropylthio) cinnamanilide hydrochloride is 54-84-2.
What is the molecular formula of 2'-(3-Dimethylaminopropylthio) cinnamanilide hydrochloride?
The molecular formula of 2'-(3-Dimethylaminopropylthio) cinnamanilide hydrochloride is C20H25ClN2OS.
What is the molecular weight of 2'-(3-Dimethylaminopropylthio) cinnamanilide hydrochloride?
The molecular weight of 2'-(3-Dimethylaminopropylthio) cinnamanilide hydrochloride is 376.14 g/mol.
Where can I buy 2'-(3-Dimethylaminopropylthio) cinnamanilide hydrochloride?
You can request a quote for 2'-(3-Dimethylaminopropylthio) cinnamanilide hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2'-(3-Dimethylaminopropylthio) cinnamanilide hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2'-(3-Dimethylaminopropylthio) cinnamanilide hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.