3,3-Diethyl-5-naphthalanmorpholinomethyl-2,4-pyridinedione
TL;DR: 3,3-Diethyl-5-naphthalanmorpholinomethyl-2,4-pyridinedione (CAS 55748-90-8) is a chemical compound with molecular formula C22H28N2O3 and molecular weight 368.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2,3,4a,5,10,10a-hexahydrobenzo[g][1,4]benzoxazin-4-ylmethyl)-3,3-diethyl-1H-pyridine-2,4-dione
Also Known As: 3,3-Diethyl-5-naphthalanmorpholinomethyl-2,4-pyridinedione, 2,4(1H,3H)-Pyridinedione, 3,3-diethyl-5-((2,3,4a,5,10,10a-hexahydro-4H-naphth(2,3-b)-1,4-oxazin-4-yl)methyl)-, 3,3-Diethyl-5-[(2,3,4a,5,10,10a-hexahydro-4H-naphtho[2,3-b][1,4]oxazin-4-yl)methyl]-2-hydroxypyridin-4(3H)-one, 5-(2,3,4a,5,10,10a-hexahydrobenzo[g][1,4]benzoxazin-4-ylmethyl)-3,3-diethyl-1H-pyridine-2,4-dione, RefChem:245268
| Molecular Formula | C22H28N2O3 |
|---|---|
| Molecular Weight | 368.21 g/mol |
| LogP | 2.2438 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 368.21 |
| Heavy Atoms | 27 |
| Complexity | 781.5175 |
Chemical Identifiers
| CAS Number | 55748-90-8 |
|---|---|
| SMILES | CCC1(C(=O)C(=CNC1=O)CN2CCOC3C2CC4=CC=CC=C4C3)CC |
Product Overview
3,3-Diethyl-5-naphthalanmorpholinomethyl-2,4-pyridinedione (CAS 55748-90-8), with molecular formula C22H28N2O3 and molecular weight 368.21 g/mol. IUPAC: 5-(2,3,4a,5,10,10a-hexahydrobenzo[g][1,4]benzoxazin-4-ylmethyl)-3,3-diethyl-1H-pyridine-2,4-dione.
Chemical Property Profile of 3,3-Diethyl-5-naphthalanmorpholinomethyl-2,4-pyridinedione
Property Insights of 3,3-Diethyl-5-naphthalanmorpholinomethyl-2,4-pyridinedione
The XLogP value of 2.2438 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-Diethyl-5-naphthalanmorpholinomethyl-2,4-pyridinedione. With a topological polar surface area (TPSA) of 58.64 Ų, 3,3-Diethyl-5-naphthalanmorpholinomethyl-2,4-pyridinedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Diethyl-5-naphthalanmorpholinomethyl-2,4-pyridinedione has 1 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 3,3-Diethyl-5-naphthalanmorpholinomethyl-2,4-pyridinedione?
The CAS number of 3,3-Diethyl-5-naphthalanmorpholinomethyl-2,4-pyridinedione is 55748-90-8.
What is the molecular formula of 3,3-Diethyl-5-naphthalanmorpholinomethyl-2,4-pyridinedione?
The molecular formula of 3,3-Diethyl-5-naphthalanmorpholinomethyl-2,4-pyridinedione is C22H28N2O3.
What is the molecular weight of 3,3-Diethyl-5-naphthalanmorpholinomethyl-2,4-pyridinedione?
The molecular weight of 3,3-Diethyl-5-naphthalanmorpholinomethyl-2,4-pyridinedione is 368.21 g/mol.
Where can I buy 3,3-Diethyl-5-naphthalanmorpholinomethyl-2,4-pyridinedione?
You can request a quote for 3,3-Diethyl-5-naphthalanmorpholinomethyl-2,4-pyridinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Diethyl-5-naphthalanmorpholinomethyl-2,4-pyridinedione?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Diethyl-5-naphthalanmorpholinomethyl-2,4-pyridinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.