1-Pipecoline, 3,4-didehydro-4-(2-(aminoethyl)thio)-, hydrochloride
TL;DR: 1-Pipecoline, 3,4-didehydro-4-(2-(aminoethyl)thio)-, hydrochloride (CAS 63868-85-9) is a chemical compound with molecular formula C8H17ClN2S and molecular weight 208.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(1-methyl-3,6-dihydro-2H-pyridin-4-yl)sulfanyl]ethanamine;hydrochloride
Also Known As: USAF A-25318, 1-Methyl-p-aminoethylthioazocyclohexane hydrochloride, 1-Pipecoline, 3,4-didehydro-4-(2-(aminoethyl)thio)-, hydrochloride, Ethylamine, 2-(1-didehydro-4-methylpiperidyl)thio-, hydrochloride, Piperidine, 4-(2-(aminoethyl)thio)-3-didehydro-1-methyl-, hydrochloride
| Molecular Formula | C8H17ClN2S |
|---|---|
| Molecular Weight | 208.08 g/mol |
| LogP | 1.3195 |
| Topological Polar Surface Area | 29.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 208.0801 |
| Heavy Atoms | 12 |
| Complexity | 149.99329 |
Chemical Identifiers
| CAS Number | 63868-85-9 |
|---|---|
| SMILES | CN1CCC(=CC1)SCCN.Cl |
Product Overview
1-Pipecoline, 3,4-didehydro-4-(2-(aminoethyl)thio)-, hydrochloride (CAS 63868-85-9), with molecular formula C8H17ClN2S and molecular weight 208.08 g/mol. IUPAC: 2-[(1-methyl-3,6-dihydro-2H-pyridin-4-yl)sulfanyl]ethanamine;hydrochloride.
Chemical Property Profile of 1-Pipecoline, 3,4-didehydro-4-(2-(aminoethyl)thio)-, hydrochloride
Property Insights of 1-Pipecoline, 3,4-didehydro-4-(2-(aminoethyl)thio)-, hydrochloride
The XLogP value of 1.3195 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Pipecoline, 3,4-didehydro-4-(2-(aminoethyl)thio)-, hydrochloride. With a topological polar surface area (TPSA) of 29.26 Ų, 1-Pipecoline, 3,4-didehydro-4-(2-(aminoethyl)thio)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Pipecoline, 3,4-didehydro-4-(2-(aminoethyl)thio)-, hydrochloride has 1 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 1-Pipecoline, 3,4-didehydro-4-(2-(aminoethyl)thio)-, hydrochloride?
The CAS number of 1-Pipecoline, 3,4-didehydro-4-(2-(aminoethyl)thio)-, hydrochloride is 63868-85-9.
What is the molecular formula of 1-Pipecoline, 3,4-didehydro-4-(2-(aminoethyl)thio)-, hydrochloride?
The molecular formula of 1-Pipecoline, 3,4-didehydro-4-(2-(aminoethyl)thio)-, hydrochloride is C8H17ClN2S.
What is the molecular weight of 1-Pipecoline, 3,4-didehydro-4-(2-(aminoethyl)thio)-, hydrochloride?
The molecular weight of 1-Pipecoline, 3,4-didehydro-4-(2-(aminoethyl)thio)-, hydrochloride is 208.08 g/mol.
Where can I buy 1-Pipecoline, 3,4-didehydro-4-(2-(aminoethyl)thio)-, hydrochloride?
You can request a quote for 1-Pipecoline, 3,4-didehydro-4-(2-(aminoethyl)thio)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Pipecoline, 3,4-didehydro-4-(2-(aminoethyl)thio)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-Pipecoline, 3,4-didehydro-4-(2-(aminoethyl)thio)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.