N-Acetylhystrine
TL;DR: N-Acetylhystrine (CAS 52195-93-4) is a chemical compound with molecular formula C12H18N2O and molecular weight 206.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-(2,3,4,5-tetrahydropyridin-6-yl)-3,4-dihydro-2H-pyridin-1-yl]ethanone
Also Known As: N-Acetylhystrine, 1-(3,4,5,5',6,6'-hexahydro-2,3'-bipyridin-1'(4'h)-yl)ethanone, 2,3'-Bipyridine, 1'-acetyl-1',3,4,4',5,5',6,6'-octahydro-, 1-[5-(2,3,4,5-tetrahydropyridin-6-yl)-3,4-dihydro-2H-pyridin-1-yl]ethanone, Propanedinitrile, 2-[2-(4-fluorophenyl)hydrazinylidene]-
| Molecular Formula | C12H18N2O |
|---|---|
| Molecular Weight | 206.14 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.1419 |
| Heavy Atoms | 15 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 52195-93-4 |
|---|---|
| SMILES | CC(=O)N1CCCC(=C1)C2=NCCCC2 |
| InChIKey | VGALILHZAQZXRB-UHFFFAOYSA-N |
Product Overview
N-Acetylhystrine (CAS 52195-93-4), with molecular formula C12H18N2O and molecular weight 206.14 g/mol. IUPAC: 1-[5-(2,3,4,5-tetrahydropyridin-6-yl)-3,4-dihydro-2H-pyridin-1-yl]ethanone.
Chemical Property Profile of N-Acetylhystrine
Property Insights of N-Acetylhystrine
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Acetylhystrine. With a topological polar surface area (TPSA) of 32.7 Ų, N-Acetylhystrine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Acetylhystrine has 0 hydrogen bond donor(s) and 2 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 N-Acetylhystrine?
The CAS number of N-Acetylhystrine is 52195-93-4.
What is the molecular formula of N-Acetylhystrine?
The molecular formula of N-Acetylhystrine is C12H18N2O.
What is the molecular weight of N-Acetylhystrine?
The molecular weight of N-Acetylhystrine is 206.14 g/mol.
Where can I buy N-Acetylhystrine?
You can request a quote for N-Acetylhystrine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Acetylhystrine?
Yes, KEHONG BIO provides custom synthesis services for N-Acetylhystrine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.