Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochloride
TL;DR: Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochloride (CAS 42971-18-6) is a chemical compound with molecular formula C17H28ClNOS and molecular weight 329.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(dimethylamino)propyl]-2-phenylsulfanylcyclohexan-1-ol;hydrochloride
Also Known As: KST-1B4242, 1-(3-Dimethylaminopropyl)-2-(phenylthio)cyclohexanol hydrochloride, 1-[3-(dimethylamino)propyl]-2-(phenylsulfanyl)cyclohexanol hydrochloride(1:1), Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochloride, 1-(3-dimethylaminopropyl)-2-phenylsulfanyl-cyclohexan-1-ol hydrochloride
| Molecular Formula | C17H28ClNOS |
|---|---|
| Molecular Weight | 329.16 g/mol |
| LogP | 4.216 |
| Topological Polar Surface Area | 48.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 329.15802 |
| Heavy Atoms | 21 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 42971-18-6 |
|---|---|
| SMILES | CN(C)CCCC1(CCCCC1SC2=CC=CC=C2)O.Cl |
| InChIKey | SBZBFDTZJCTDQL-UHFFFAOYSA-N |
Product Overview
Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochloride (CAS 42971-18-6), with molecular formula C17H28ClNOS and molecular weight 329.16 g/mol. IUPAC: 1-[3-(dimethylamino)propyl]-2-phenylsulfanylcyclohexan-1-ol;hydrochloride.
Chemical Property Profile of Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochloride
Property Insights of Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochloride
The XLogP value of 4.216 indicates that Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.8 Ų, Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, 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 Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochloride?
The CAS number of Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochloride is 42971-18-6.
What is the molecular formula of Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochloride?
The molecular formula of Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochloride is C17H28ClNOS.
What is the molecular weight of Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochloride?
The molecular weight of Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochloride is 329.16 g/mol.
Where can I buy Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochloride?
You can request a quote for Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexanol, 1-(3-(dimethylamino)propyl)-2-(phenylthio)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.