Valeric acid, 2-propylthio-, O-ester with 2-piperidineethanol, hydrochloride
TL;DR: Valeric acid, 2-propylthio-, O-ester with 2-piperidineethanol, hydrochloride (CAS 69226-68-2) is a chemical compound with molecular formula C15H30ClNO2S and molecular weight 323.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-piperidin-1-ylethyl 2-propylsulfanylpentanoate;hydrochloride
Also Known As: 2-Propylthiovaleric acid O-ester with 2-piperidineethanol hydrochloride, Valeric acid, 2-propylthio-, O-ester with 2-piperidineethanol, hydrochloride, 2-piperidin-1-ylethyl 2-propylsulfanylpentanoate hydrochloride, 2-(Piperidin-1-yl)ethyl 2-(propylsulfanyl)pentanoate--hydrogen chloride (1/1), Pentanoic acid, 2-(propylthio)-, 2-(1-piperidinyl)ethyl ester, hydrochloride
| Molecular Formula | C15H30ClNO2S |
|---|---|
| Molecular Weight | 323.17 g/mol |
| LogP | 3.7492 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 323.16858 |
| Heavy Atoms | 20 |
| Complexity | 248.02802 |
Chemical Identifiers
| CAS Number | 69226-68-2 |
|---|---|
| SMILES | CCCC(C(=O)OCCN1CCCCC1)SCCC.Cl |
Product Overview
Valeric acid, 2-propylthio-, O-ester with 2-piperidineethanol, hydrochloride (CAS 69226-68-2), with molecular formula C15H30ClNO2S and molecular weight 323.17 g/mol. IUPAC: 2-piperidin-1-ylethyl 2-propylsulfanylpentanoate;hydrochloride.
Chemical Property Profile of Valeric acid, 2-propylthio-, O-ester with 2-piperidineethanol, hydrochloride
Property Insights of Valeric acid, 2-propylthio-, O-ester with 2-piperidineethanol, hydrochloride
The XLogP value of 3.7492 indicates that Valeric acid, 2-propylthio-, O-ester with 2-piperidineethanol, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, Valeric acid, 2-propylthio-, O-ester with 2-piperidineethanol, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Valeric acid, 2-propylthio-, O-ester with 2-piperidineethanol, hydrochloride has 0 hydrogen bond donor(s) and 4 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 Valeric acid, 2-propylthio-, O-ester with 2-piperidineethanol, hydrochloride?
The CAS number of Valeric acid, 2-propylthio-, O-ester with 2-piperidineethanol, hydrochloride is 69226-68-2.
What is the molecular formula of Valeric acid, 2-propylthio-, O-ester with 2-piperidineethanol, hydrochloride?
The molecular formula of Valeric acid, 2-propylthio-, O-ester with 2-piperidineethanol, hydrochloride is C15H30ClNO2S.
What is the molecular weight of Valeric acid, 2-propylthio-, O-ester with 2-piperidineethanol, hydrochloride?
The molecular weight of Valeric acid, 2-propylthio-, O-ester with 2-piperidineethanol, hydrochloride is 323.17 g/mol.
Where can I buy Valeric acid, 2-propylthio-, O-ester with 2-piperidineethanol, hydrochloride?
You can request a quote for Valeric acid, 2-propylthio-, O-ester with 2-piperidineethanol, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Valeric acid, 2-propylthio-, O-ester with 2-piperidineethanol, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Valeric acid, 2-propylthio-, O-ester with 2-piperidineethanol, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.