Homostachydrine
TL;DR: Homostachydrine (CAS 472-22-0) is a chemical compound with molecular formula C8H16NO2+ and molecular weight 158.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-1,1-dimethylpiperidin-1-ium-2-carboxylic acid
Also Known As: Homostachydrine, Pipecolic acid betaine, Homostachydrine, (-)-, (2S)-1,1-dimethylpiperidin-1-ium-2-carboxylic acid, Piperidinium, 2-carboxy-1,1-dimethyl-, inner salt, (2S)-
| Molecular Formula | C8H16NO2+ |
|---|---|
| Molecular Weight | 158.12 g/mol |
| LogP | 0.6999 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 158.1181 |
| Heavy Atoms | 11 |
| Complexity | 165.47499 |
Chemical Identifiers
| CAS Number | 472-22-0 |
|---|---|
| SMILES | C[N+]1(CCCC[C@H]1C(=O)O)C |
Product Overview
Homostachydrine (CAS 472-22-0), with molecular formula C8H16NO2+ and molecular weight 158.12 g/mol. IUPAC: (2S)-1,1-dimethylpiperidin-1-ium-2-carboxylic acid.
Chemical Property Profile of Homostachydrine
Property Insights of Homostachydrine
The XLogP value of 0.6999 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Homostachydrine. With a topological polar surface area (TPSA) of 37.3 Ų, Homostachydrine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Homostachydrine has 1 hydrogen bond donor(s) and 1 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 Homostachydrine?
The CAS number of Homostachydrine is 472-22-0.
What is the molecular formula of Homostachydrine?
The molecular formula of Homostachydrine is C8H16NO2+.
What is the molecular weight of Homostachydrine?
The molecular weight of Homostachydrine is 158.12 g/mol.
Where can I buy Homostachydrine?
You can request a quote for Homostachydrine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Homostachydrine?
Yes, KEHONG BIO provides custom synthesis services for Homostachydrine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.