Anatabine, N-formyl
TL;DR: Anatabine, N-formyl (CAS 77264-87-0) is a chemical compound with molecular formula C11H12N2O and molecular weight 188.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pyridin-3-yl-3,6-dihydro-2H-pyridine-1-carbaldehyde
Also Known As: Anatabine, N-formyl, 3,6-dihydro-2,3'-bipyridine-1(2h)-carbaldehyde, 2-pyridin-3-yl-3,6-dihydro-2H-pyridine-1-carbaldehyde, 1,2,3,6-tetrahydro-[2,3'-bipyridine]-1-carbaldehyde, 3,6-Dihydro-[2,3'-bipyridine]-1(2H)-carbaldehyde
| Molecular Formula | C11H12N2O |
|---|---|
| Molecular Weight | 188.09 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 33.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.09496 |
| Heavy Atoms | 14 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 77264-87-0 |
|---|---|
| SMILES | C1C=CCN(C1C2=CN=CC=C2)C=O |
| InChIKey | IIXFXMGADSMCLR-UHFFFAOYSA-N |
Product Overview
Anatabine, N-formyl (CAS 77264-87-0), with molecular formula C11H12N2O and molecular weight 188.09 g/mol. IUPAC: 2-pyridin-3-yl-3,6-dihydro-2H-pyridine-1-carbaldehyde.
Chemical Property Profile of Anatabine, N-formyl
Property Insights of Anatabine, N-formyl
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Anatabine, N-formyl. With a topological polar surface area (TPSA) of 33.2 Ų, Anatabine, N-formyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Anatabine, N-formyl 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 Anatabine, N-formyl?
The CAS number of Anatabine, N-formyl is 77264-87-0.
What is the molecular formula of Anatabine, N-formyl?
The molecular formula of Anatabine, N-formyl is C11H12N2O.
What is the molecular weight of Anatabine, N-formyl?
The molecular weight of Anatabine, N-formyl is 188.09 g/mol.
Where can I buy Anatabine, N-formyl?
You can request a quote for Anatabine, N-formyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Anatabine, N-formyl?
Yes, KEHONG BIO provides custom synthesis services for Anatabine, N-formyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.