5,5-Diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione
TL;DR: 5,5-Diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione (CAS 586989-77-7) is a chemical compound with molecular formula C16H21NO3 and molecular weight 275.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione
Also Known As: TimTec1_006607, 5,5-diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione, A3329/0141341, 5,5-diethyl-3,3-dimethyl-6-(pyridin-2-yl)dihydro-2H-pyran-2,4(3H)-dione, 5,5-diethyl-3,3-dimethyl-6-(2-pyridyl)tetra-hydropyran-2,4-dione
| Molecular Formula | C16H21NO3 |
|---|---|
| Molecular Weight | 275.15 g/mol |
| LogP | 3.0812 |
| Topological Polar Surface Area | 56.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 275.15213 |
| Heavy Atoms | 20 |
| Complexity | 517.7833 |
Chemical Identifiers
| CAS Number | 586989-77-7 |
|---|---|
| SMILES | CCC1(C(OC(=O)C(C1=O)(C)C)C2=CC=CC=N2)CC |
Product Overview
5,5-Diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione (CAS 586989-77-7), with molecular formula C16H21NO3 and molecular weight 275.15 g/mol. IUPAC: 5,5-diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione.
Chemical Property Profile of 5,5-Diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione
Property Insights of 5,5-Diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione
The XLogP value of 3.0812 indicates that 5,5-Diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.26 Ų, 5,5-Diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,5-Diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione has 0 hydrogen bond donor(s) and 4 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 5,5-Diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione?
The CAS number of 5,5-Diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione is 586989-77-7.
What is the molecular formula of 5,5-Diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione?
The molecular formula of 5,5-Diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione is C16H21NO3.
What is the molecular weight of 5,5-Diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione?
The molecular weight of 5,5-Diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione is 275.15 g/mol.
Where can I buy 5,5-Diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione?
You can request a quote for 5,5-Diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5-Diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 5,5-Diethyl-3,3-dimethyl-6-pyridin-2-yloxane-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.