1-Benzyl-5-ethyl-1,2,5,6-tetrahydro-2-oxo-4-pyridineacetic acid
TL;DR: 1-Benzyl-5-ethyl-1,2,5,6-tetrahydro-2-oxo-4-pyridineacetic acid (CAS 7715-89-1) is a chemical compound with molecular formula C16H19NO3 and molecular weight 273.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-benzyl-3-ethyl-6-oxo-2,3-dihydropyridin-4-yl)acetic acid
Also Known As: 1-Betopa, KST-1A8165, 1-Benzyl-5-ethyl-1,2,5,6-tetrahydro-2-oxo-4-pyridineacetic acid, (1-benzyl-3-ethyl-6-oxo-1,2,3,6-tetrahydropyridin-4-yl)acetic acid, 4-Pyridineacetic acid, 5-ethyl-1,2,5,6-tetrahydro-2-oxo-1-(phenylmethyl)-
| Molecular Formula | C16H19NO3 |
|---|---|
| Molecular Weight | 273.14 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 273.1365 |
| Heavy Atoms | 20 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 7715-89-1 |
|---|---|
| SMILES | CCC1CN(C(=O)C=C1CC(=O)O)CC2=CC=CC=C2 |
| InChIKey | REGMMYUYMPQUQS-UHFFFAOYSA-N |
Product Overview
1-Benzyl-5-ethyl-1,2,5,6-tetrahydro-2-oxo-4-pyridineacetic acid (CAS 7715-89-1), with molecular formula C16H19NO3 and molecular weight 273.14 g/mol. IUPAC: 2-(1-benzyl-3-ethyl-6-oxo-2,3-dihydropyridin-4-yl)acetic acid.
Chemical Property Profile of 1-Benzyl-5-ethyl-1,2,5,6-tetrahydro-2-oxo-4-pyridineacetic acid
Property Insights of 1-Benzyl-5-ethyl-1,2,5,6-tetrahydro-2-oxo-4-pyridineacetic acid
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzyl-5-ethyl-1,2,5,6-tetrahydro-2-oxo-4-pyridineacetic acid. With a topological polar surface area (TPSA) of 57.6 Ų, 1-Benzyl-5-ethyl-1,2,5,6-tetrahydro-2-oxo-4-pyridineacetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-5-ethyl-1,2,5,6-tetrahydro-2-oxo-4-pyridineacetic acid 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-Benzyl-5-ethyl-1,2,5,6-tetrahydro-2-oxo-4-pyridineacetic acid?
The CAS number of 1-Benzyl-5-ethyl-1,2,5,6-tetrahydro-2-oxo-4-pyridineacetic acid is 7715-89-1.
What is the molecular formula of 1-Benzyl-5-ethyl-1,2,5,6-tetrahydro-2-oxo-4-pyridineacetic acid?
The molecular formula of 1-Benzyl-5-ethyl-1,2,5,6-tetrahydro-2-oxo-4-pyridineacetic acid is C16H19NO3.
What is the molecular weight of 1-Benzyl-5-ethyl-1,2,5,6-tetrahydro-2-oxo-4-pyridineacetic acid?
The molecular weight of 1-Benzyl-5-ethyl-1,2,5,6-tetrahydro-2-oxo-4-pyridineacetic acid is 273.14 g/mol.
Where can I buy 1-Benzyl-5-ethyl-1,2,5,6-tetrahydro-2-oxo-4-pyridineacetic acid?
You can request a quote for 1-Benzyl-5-ethyl-1,2,5,6-tetrahydro-2-oxo-4-pyridineacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-5-ethyl-1,2,5,6-tetrahydro-2-oxo-4-pyridineacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-5-ethyl-1,2,5,6-tetrahydro-2-oxo-4-pyridineacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.