![N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-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)propionamide structure](/static/products/879/879461-15-1.png)
N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-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)propionamide
TL;DR: N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-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)propionamide (CAS 879461-15-1) is a chemical compound with molecular formula C26H27N5O6 and molecular weight 505.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3'-(1,3-benzodioxol-5-ylmethyl)-2,4,6-trioxospiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-8'-yl]propanamide
Also Known As: N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-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)propionamide, N-[3'-(1,3-benzodioxol-5-ylmethyl)-2,4,6-trioxospiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-8'-yl]propanamide, N-[3-(1,3-benzodioxol-5-ylmethyl)-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]propanamide
| Molecular Formula | C26H27N5O6 |
|---|---|
| Molecular Weight | 505.20 g/mol |
| LogP | 1.3631 |
| Topological Polar Surface Area | 129.31 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 505.19614 |
| Heavy Atoms | 37 |
| Complexity | 1306.5306 |
Chemical Identifiers
| CAS Number | 879461-15-1 |
|---|---|
| SMILES | CCC(=O)NC1=CC2=C(C=C1)N3CCN(CC3C4(C2)C(=O)NC(=O)NC4=O)CC5=CC6=C(C=C5)OCO6 |
Product Overview
N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-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)propionamide (CAS 879461-15-1), with molecular formula C26H27N5O6 and molecular weight 505.20 g/mol. IUPAC: N-[3'-(1,3-benzodioxol-5-ylmethyl)-2,4,6-trioxospiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-8'-yl]propanamide.
Chemical Property Profile of N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-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)propionamide
Property Insights of N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-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)propionamide
The XLogP value of 1.3631 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-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)propionamide. The TPSA of 129.31 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-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)propionamide. Following Lipinski's Rule of Five, N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-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)propionamide has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-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)propionamide?
The CAS number of N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-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)propionamide is 879461-15-1.
What is the molecular formula of N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-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)propionamide?
The molecular formula of N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-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)propionamide is C26H27N5O6.
What is the molecular weight of N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-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)propionamide?
The molecular weight of N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-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)propionamide is 505.20 g/mol.
Where can I buy N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-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)propionamide?
You can request a quote for N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-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)propionamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-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)propionamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-(benzo[d][1,3]dioxol-5-ylmethyl)-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)propionamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.