3-[(Benzoxazol-2-yl)methyl]-5-ethyl-6-methylpyridin-2(1H)-one
TL;DR: 3-[(Benzoxazol-2-yl)methyl]-5-ethyl-6-methylpyridin-2(1H)-one (CAS 147440-22-0) is a chemical compound with molecular formula C16H16N2O2 and molecular weight 268.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzoxazol-2-ylmethyl)-5-ethyl-6-methyl-1H-pyridin-2-one
Also Known As: 2-Pyridinone deriv., 2-Pyridinone derivative 44, 3-[(Benzoxazol-2-yl)methyl]-5-ethyl-6-methylpyridin-2(1H)-one, 3-(1,3-benzoxazol-2-ylmethyl)-5-ethyl-6-methyl-1H-pyridin-2-one, 3-(2-Benzoxazolylmethyl)-5-ethyl-6-methyl-2(1H)-pyridinone
| Molecular Formula | C16H16N2O2 |
|---|---|
| Molecular Weight | 268.12 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.1212 |
| Heavy Atoms | 20 |
| Complexity | 467.0 |
Chemical Identifiers
| CAS Number | 147440-22-0 |
|---|---|
| SMILES | CCC1=C(NC(=O)C(=C1)CC2=NC3=CC=CC=C3O2)C |
| InChIKey | BUYNMGMCEWNECY-UHFFFAOYSA-N |
Product Overview
3-[(Benzoxazol-2-yl)methyl]-5-ethyl-6-methylpyridin-2(1H)-one (CAS 147440-22-0), with molecular formula C16H16N2O2 and molecular weight 268.12 g/mol. IUPAC: 3-(1,3-benzoxazol-2-ylmethyl)-5-ethyl-6-methyl-1H-pyridin-2-one.
Chemical Property Profile of 3-[(Benzoxazol-2-yl)methyl]-5-ethyl-6-methylpyridin-2(1H)-one
Property Insights of 3-[(Benzoxazol-2-yl)methyl]-5-ethyl-6-methylpyridin-2(1H)-one
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(Benzoxazol-2-yl)methyl]-5-ethyl-6-methylpyridin-2(1H)-one. With a topological polar surface area (TPSA) of 55.1 Ų, 3-[(Benzoxazol-2-yl)methyl]-5-ethyl-6-methylpyridin-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(Benzoxazol-2-yl)methyl]-5-ethyl-6-methylpyridin-2(1H)-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 3-[(Benzoxazol-2-yl)methyl]-5-ethyl-6-methylpyridin-2(1H)-one?
The CAS number of 3-[(Benzoxazol-2-yl)methyl]-5-ethyl-6-methylpyridin-2(1H)-one is 147440-22-0.
What is the molecular formula of 3-[(Benzoxazol-2-yl)methyl]-5-ethyl-6-methylpyridin-2(1H)-one?
The molecular formula of 3-[(Benzoxazol-2-yl)methyl]-5-ethyl-6-methylpyridin-2(1H)-one is C16H16N2O2.
What is the molecular weight of 3-[(Benzoxazol-2-yl)methyl]-5-ethyl-6-methylpyridin-2(1H)-one?
The molecular weight of 3-[(Benzoxazol-2-yl)methyl]-5-ethyl-6-methylpyridin-2(1H)-one is 268.12 g/mol.
Where can I buy 3-[(Benzoxazol-2-yl)methyl]-5-ethyl-6-methylpyridin-2(1H)-one?
You can request a quote for 3-[(Benzoxazol-2-yl)methyl]-5-ethyl-6-methylpyridin-2(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(Benzoxazol-2-yl)methyl]-5-ethyl-6-methylpyridin-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[(Benzoxazol-2-yl)methyl]-5-ethyl-6-methylpyridin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.