1,1'-(2,4-Dimethyl-1,4-dihydropyridine-3,5-diyl)di(ethan-1-one)
TL;DR: 1,1'-(2,4-Dimethyl-1,4-dihydropyridine-3,5-diyl)di(ethan-1-one) (CAS 1079-95-4) is a chemical compound with molecular formula C11H15NO2 and molecular weight 193.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-acetyl-4,6-dimethyl-1,4-dihydropyridin-3-yl)ethanone
Also Known As: KST-1A9812, 3,5-Diacetyl-1,4-dihydrolutidine, 1,1'-(2,4-dimethyl-1,4-dihydropyridine-3,5-diyl)diethanone, 1-(5-acetyl-4,6-dimethyl-1,4-dihydropyridin-3-yl)ethanone, 1,1'-(2,4-Dimethyl-1,4-dihydropyridine-3,5-diyl)di(ethan-1-one)
| Molecular Formula | C11H15NO2 |
|---|---|
| Molecular Weight | 193.11 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 193.11028 |
| Heavy Atoms | 14 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 1079-95-4 |
|---|---|
| SMILES | CC1C(=CNC(=C1C(=O)C)C)C(=O)C |
| InChIKey | GDIXGDQPNJBFFD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1'-(2,4-Dimethyl-1,4-dihydropyridine-3,5-diyl)di(ethan-1-one) (CAS 1079-95-4), with molecular formula C11H15NO2 and molecular weight 193.11 g/mol. IUPAC: 1-(5-acetyl-4,6-dimethyl-1,4-dihydropyridin-3-yl)ethanone.
Chemical Property Profile of 1,1'-(2,4-Dimethyl-1,4-dihydropyridine-3,5-diyl)di(ethan-1-one)
Property Insights of 1,1'-(2,4-Dimethyl-1,4-dihydropyridine-3,5-diyl)di(ethan-1-one)
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1'-(2,4-Dimethyl-1,4-dihydropyridine-3,5-diyl)di(ethan-1-one). With a topological polar surface area (TPSA) of 46.2 Ų, 1,1'-(2,4-Dimethyl-1,4-dihydropyridine-3,5-diyl)di(ethan-1-one) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1'-(2,4-Dimethyl-1,4-dihydropyridine-3,5-diyl)di(ethan-1-one) 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 1,1'-(2,4-Dimethyl-1,4-dihydropyridine-3,5-diyl)di(ethan-1-one)?
The CAS number of 1,1'-(2,4-Dimethyl-1,4-dihydropyridine-3,5-diyl)di(ethan-1-one) is 1079-95-4.
What is the molecular formula of 1,1'-(2,4-Dimethyl-1,4-dihydropyridine-3,5-diyl)di(ethan-1-one)?
The molecular formula of 1,1'-(2,4-Dimethyl-1,4-dihydropyridine-3,5-diyl)di(ethan-1-one) is C11H15NO2.
What is the molecular weight of 1,1'-(2,4-Dimethyl-1,4-dihydropyridine-3,5-diyl)di(ethan-1-one)?
The molecular weight of 1,1'-(2,4-Dimethyl-1,4-dihydropyridine-3,5-diyl)di(ethan-1-one) is 193.11 g/mol.
Where can I buy 1,1'-(2,4-Dimethyl-1,4-dihydropyridine-3,5-diyl)di(ethan-1-one)?
You can request a quote for 1,1'-(2,4-Dimethyl-1,4-dihydropyridine-3,5-diyl)di(ethan-1-one) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-(2,4-Dimethyl-1,4-dihydropyridine-3,5-diyl)di(ethan-1-one)?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-(2,4-Dimethyl-1,4-dihydropyridine-3,5-diyl)di(ethan-1-one) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.