1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone
TL;DR: 1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone (CAS 64497-95-6) is a chemical compound with molecular formula C15H17NO and molecular weight 227.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone
Also Known As: 1- ETHANONE, 1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone, 4,4'-diamino-3-methyl diphenyl methane, 1-(1-Benzyl-5-methyl-1,4-dihydropyridin-3-yl)ethan-1-one, Ethanone,1-[1,4-dihydro-5-methyl-1-(phenylmethyl)-3-pyridinyl]-
| Molecular Formula | C15H17NO |
|---|---|
| Molecular Weight | 227.13 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.13101 |
| Heavy Atoms | 17 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 64497-95-6 |
|---|---|
| SMILES | CC1=CN(C=C(C1)C(=O)C)CC2=CC=CC=C2 |
| InChIKey | HSFUOCFDKDABGW-UHFFFAOYSA-N |
Product Overview
1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone (CAS 64497-95-6), with molecular formula C15H17NO and molecular weight 227.13 g/mol. IUPAC: 1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone.
Chemical Property Profile of 1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone
Property Insights of 1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone. With a topological polar surface area (TPSA) of 20.3 Ų, 1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone 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 1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone?
The CAS number of 1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone is 64497-95-6.
What is the molecular formula of 1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone?
The molecular formula of 1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone is C15H17NO.
What is the molecular weight of 1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone?
The molecular weight of 1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone is 227.13 g/mol.
Where can I buy 1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone?
You can request a quote for 1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-benzyl-5-methyl-4H-pyridin-3-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.