ChemDiv1_016442
TL;DR: ChemDiv1_016442 (CAS 423138-00-5) is a chemical compound with molecular formula C26H34N2O6 and molecular weight 470.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,7,7-trimethyl-3-(morpholine-4-carbonyl)-4-(2,4,5-trimethoxyphenyl)-1,4,6,8-tetrahydroquinolin-5-one
Also Known As: ChemDiv1_016442, AE-848/42025041, 2,7,7-trimethyl-3-(4-morpholinylcarbonyl)-4-(2,4,5-trimethoxyphenyl)-4,6,7,8-tetrahydro-5(1H)-quinolinone, 2,7,7-trimethyl-3-(morpholine-4-carbonyl)-4-(2,4,5-trimethoxyphenyl)-1,4,6,8-tetrahydroquinolin-5-one, 2,7,7-trimethyl-3-(morpholin-4-ylcarbonyl)-4-(2,4,5-trimethoxyphenyl)-1,4,6,7, 8-pentahydroquinolin-5-one
| Molecular Formula | C26H34N2O6 |
|---|---|
| Molecular Weight | 470.24 g/mol |
| LogP | 3.1752 |
| Topological Polar Surface Area | 86.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 470.2417 |
| Heavy Atoms | 34 |
| Complexity | 1065.2943 |
Chemical Identifiers
| CAS Number | 423138-00-5 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C=C3OC)OC)OC)C(=O)N4CCOCC4 |
Product Overview
ChemDiv1_016442 (CAS 423138-00-5), with molecular formula C26H34N2O6 and molecular weight 470.24 g/mol. IUPAC: 2,7,7-trimethyl-3-(morpholine-4-carbonyl)-4-(2,4,5-trimethoxyphenyl)-1,4,6,8-tetrahydroquinolin-5-one.
Chemical Property Profile of ChemDiv1_016442
Property Insights of ChemDiv1_016442
The XLogP value of 3.1752 indicates that ChemDiv1_016442 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.33 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_016442. Following Lipinski's Rule of Five, ChemDiv1_016442 has 1 hydrogen bond donor(s) and 7 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 ChemDiv1_016442?
The CAS number of ChemDiv1_016442 is 423138-00-5.
What is the molecular formula of ChemDiv1_016442?
The molecular formula of ChemDiv1_016442 is C26H34N2O6.
What is the molecular weight of ChemDiv1_016442?
The molecular weight of ChemDiv1_016442 is 470.24 g/mol.
Where can I buy ChemDiv1_016442?
You can request a quote for ChemDiv1_016442 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_016442?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_016442 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.