2,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl-
TL;DR: 2,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl- (CAS 20970-67-6) is a chemical compound with molecular formula C17H19NO2 and molecular weight 269.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-acetyl-2,6-dimethyl-4-phenyl-1,4-dihydropyridin-3-yl)ethanone
Also Known As: 2,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl-, 2,6-Dimethyl-3,5-diacetyl-4-phenyl-1,4-dihydropyridine, 4-Phenyl-2,6-dimethyl-3,5-diacetyl-1,4-dihydropyridine, BAS 00415406, 2, 3,5-diacetyl-1,4-dihydro-4-phenyl-
| Molecular Formula | C17H19NO2 |
|---|---|
| Molecular Weight | 269.14 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.14157 |
| Heavy Atoms | 20 |
| Complexity | 457.0 |
| Solubility | 35.3 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 20970-67-6 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)C)C(=O)C)C2=CC=CC=C2)C(=O)C |
| InChIKey | GAJJRTVBAXALLD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl- (CAS 20970-67-6), with molecular formula C17H19NO2 and molecular weight 269.14 g/mol. IUPAC: 1-(5-acetyl-2,6-dimethyl-4-phenyl-1,4-dihydropyridin-3-yl)ethanone.
Chemical Property Profile of 2,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl-
Property Insights of 2,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl-. With a topological polar surface area (TPSA) of 46.2 Ų, 2,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl- 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 2,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl-?
The CAS number of 2,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl- is 20970-67-6.
What is the molecular formula of 2,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl-?
The molecular formula of 2,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl- is C17H19NO2.
What is the molecular weight of 2,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl-?
The molecular weight of 2,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl- is 269.14 g/mol.
Where can I buy 2,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl-?
You can request a quote for 2,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.