![N-(3-(2-fluorophenyl)-2',4',6'-trioxo-1,2,2',3,3',4,4a,4',6,6'-decahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide structure](/static/products/896/896673-97-5.png)
N-(3-(2-fluorophenyl)-2',4',6'-trioxo-1,2,2',3,3',4,4a,4',6,6'-decahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide
TL;DR: N-(3-(2-fluorophenyl)-2',4',6'-trioxo-1,2,2',3,3',4,4a,4',6,6'-decahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide (CAS 896673-97-5) is a chemical compound with molecular formula C23H22FN5O4 and molecular weight 451.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3'-(2-fluorophenyl)-2,4,6-trioxospiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-8'-yl]acetamide
Also Known As: N-(3-(2-fluorophenyl)-2',4',6'-trioxo-1,2,2',3,3',4,4a,4',6,6'-decahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide, N-[3'-(2-fluorophenyl)-2,4,6-trioxospiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-8'-yl]acetamide, N-[3-(2-fluorophenyl)-2',6'-dihydroxy-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl]acetamide
| Molecular Formula | C23H22FN5O4 |
|---|---|
| Molecular Weight | 451.17 g/mol |
| LogP | 1.3878 |
| Topological Polar Surface Area | 110.85 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 451.1656 |
| Heavy Atoms | 33 |
| Complexity | 1179.1243 |
Chemical Identifiers
| CAS Number | 896673-97-5 |
|---|---|
| SMILES | CC(=O)NC1=CC2=C(C=C1)N3CCN(CC3C4(C2)C(=O)NC(=O)NC4=O)C5=CC=CC=C5F |
Product Overview
N-(3-(2-fluorophenyl)-2',4',6'-trioxo-1,2,2',3,3',4,4a,4',6,6'-decahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide (CAS 896673-97-5), with molecular formula C23H22FN5O4 and molecular weight 451.17 g/mol. IUPAC: N-[3'-(2-fluorophenyl)-2,4,6-trioxospiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-8'-yl]acetamide.
Chemical Property Profile of N-(3-(2-fluorophenyl)-2',4',6'-trioxo-1,2,2',3,3',4,4a,4',6,6'-decahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide
Property Insights of N-(3-(2-fluorophenyl)-2',4',6'-trioxo-1,2,2',3,3',4,4a,4',6,6'-decahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide
The XLogP value of 1.3878 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-(2-fluorophenyl)-2',4',6'-trioxo-1,2,2',3,3',4,4a,4',6,6'-decahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide. The TPSA of 110.85 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-(2-fluorophenyl)-2',4',6'-trioxo-1,2,2',3,3',4,4a,4',6,6'-decahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide. Following Lipinski's Rule of Five, N-(3-(2-fluorophenyl)-2',4',6'-trioxo-1,2,2',3,3',4,4a,4',6,6'-decahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide has 3 hydrogen bond donor(s) and 6 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 N-(3-(2-fluorophenyl)-2',4',6'-trioxo-1,2,2',3,3',4,4a,4',6,6'-decahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide?
The CAS number of N-(3-(2-fluorophenyl)-2',4',6'-trioxo-1,2,2',3,3',4,4a,4',6,6'-decahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide is 896673-97-5.
What is the molecular formula of N-(3-(2-fluorophenyl)-2',4',6'-trioxo-1,2,2',3,3',4,4a,4',6,6'-decahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide?
The molecular formula of N-(3-(2-fluorophenyl)-2',4',6'-trioxo-1,2,2',3,3',4,4a,4',6,6'-decahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide is C23H22FN5O4.
What is the molecular weight of N-(3-(2-fluorophenyl)-2',4',6'-trioxo-1,2,2',3,3',4,4a,4',6,6'-decahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide?
The molecular weight of N-(3-(2-fluorophenyl)-2',4',6'-trioxo-1,2,2',3,3',4,4a,4',6,6'-decahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide is 451.17 g/mol.
Where can I buy N-(3-(2-fluorophenyl)-2',4',6'-trioxo-1,2,2',3,3',4,4a,4',6,6'-decahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide?
You can request a quote for N-(3-(2-fluorophenyl)-2',4',6'-trioxo-1,2,2',3,3',4,4a,4',6,6'-decahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-(2-fluorophenyl)-2',4',6'-trioxo-1,2,2',3,3',4,4a,4',6,6'-decahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-(2-fluorophenyl)-2',4',6'-trioxo-1,2,2',3,3',4,4a,4',6,6'-decahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.