![Ethyl 4-{[(3-oxodecahydroquinoxalin-2-yl)acetyl]amino}benzoate structure](/static/products/1008/1008423-15-1.webp)
Ethyl 4-{[(3-oxodecahydroquinoxalin-2-yl)acetyl]amino}benzoate
TL;DR: Ethyl 4-{[(3-oxodecahydroquinoxalin-2-yl)acetyl]amino}benzoate (CAS 1008423-15-1) is a chemical compound with molecular formula C19H25N3O4 and molecular weight 359.1845 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 4-[[2-(3-oxo-2,4,4a,5,6,7,8,8a-octahydro-1H-quinoxalin-2-yl)acetyl]amino]benzoate
Also Known As: CBKinase1_007848, CBKinase1_020248, BAS 08978474, ethyl 4-{[(3-oxodecahydroquinoxalin-2-yl)acetyl]amino}benzoate, BRD-A46577705-001-01-6
Technical Specifications
| Molecular Formula | C19H25N3O4 |
| Molecular Weight | 359.1845 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 96.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 359.1845 Da |
| Heavy Atoms | 26 |
| Complexity | 531.0 |
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CC2C(=O)NC3CCCCC3N2 |
| InChIKey | VLIXPVZDBZWYJY-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 4-{[(3-oxodecahydroquinoxalin-2-yl)acetyl]amino}benzoate
Property Insights of Ethyl 4-{[(3-oxodecahydroquinoxalin-2-yl)acetyl]amino}benzoate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-{[(3-oxodecahydroquinoxalin-2-yl)acetyl]amino}benzoate. The TPSA of 96.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-{[(3-oxodecahydroquinoxalin-2-yl)acetyl]amino}benzoate. Following Lipinski's Rule of Five, Ethyl 4-{[(3-oxodecahydroquinoxalin-2-yl)acetyl]amino}benzoate has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethyl 4-{[(3-oxodecahydroquinoxalin-2-yl)acetyl]amino}benzoate?
The CAS number of Ethyl 4-{[(3-oxodecahydroquinoxalin-2-yl)acetyl]amino}benzoate is 1008423-15-1.
What is the molecular formula of Ethyl 4-{[(3-oxodecahydroquinoxalin-2-yl)acetyl]amino}benzoate?
The molecular formula of Ethyl 4-{[(3-oxodecahydroquinoxalin-2-yl)acetyl]amino}benzoate is C19H25N3O4.
What is the molecular weight of Ethyl 4-{[(3-oxodecahydroquinoxalin-2-yl)acetyl]amino}benzoate?
The molecular weight of Ethyl 4-{[(3-oxodecahydroquinoxalin-2-yl)acetyl]amino}benzoate is 359.1845 g/mol.
Where can I buy Ethyl 4-{[(3-oxodecahydroquinoxalin-2-yl)acetyl]amino}benzoate?
You can request a quote for Ethyl 4-{[(3-oxodecahydroquinoxalin-2-yl)acetyl]amino}benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 4-{[(3-oxodecahydroquinoxalin-2-yl)acetyl]amino}benzoate?
Yes, CoreyChem provides custom synthesis services for Ethyl 4-{[(3-oxodecahydroquinoxalin-2-yl)acetyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.