(Z)-7'-((1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-1,3-dimethyl-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione
TL;DR: (Z)-7'-((1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-1,3-dimethyl-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione (CAS 892627-01-9) is a chemical compound with molecular formula C24H25N5O6 and molecular weight 479.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7'-[(Z)-(1-ethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-1,3-dimethylspiro[1,3-diazinane-5,4'-2,3,3a,5-tetrahydro-1H-pyrrolo[1,2-a]quinoline]-2,4,6-trione
Also Known As: (Z)-7'-((1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-1,3-dimethyl-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione, 7'-[(Z)-(1-ethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-1,3-dimethylspiro[1,3-diazinane-5,4'-2,3,3a,5-tetrahydro-1H-pyrrolo[1,2-a]quinoline]-2,4,6-trione, 7'-[(Z)-(1-ethyl-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene)methyl]-1,3-dimethyl-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(1H,3H)-trione
| Molecular Formula | C24H25N5O6 |
|---|---|
| Molecular Weight | 479.18 g/mol |
| LogP | 0.73 |
| Topological Polar Surface Area | 127.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 479.18048 |
| Heavy Atoms | 35 |
| Complexity | 1228.7915 |
Chemical Identifiers
| CAS Number | 892627-01-9 |
|---|---|
| SMILES | CCN1C(=O)/C(=C\C2=CC3=C(C=C2)N4CCCC4C5(C3)C(=O)N(C(=O)N(C5=O)C)C)/C(=O)NC1=O |
Product Overview
(Z)-7'-((1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-1,3-dimethyl-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione (CAS 892627-01-9), with molecular formula C24H25N5O6 and molecular weight 479.18 g/mol. IUPAC: 7'-[(Z)-(1-ethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-1,3-dimethylspiro[1,3-diazinane-5,4'-2,3,3a,5-tetrahydro-1H-pyrrolo[1,2-a]quinoline]-2,4,6-trione.
Chemical Property Profile of (Z)-7'-((1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-1,3-dimethyl-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione
Property Insights of (Z)-7'-((1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-1,3-dimethyl-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione
The XLogP value of 0.73 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-7'-((1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-1,3-dimethyl-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione. The TPSA of 127.41 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-7'-((1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-1,3-dimethyl-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione. Following Lipinski's Rule of Five, (Z)-7'-((1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-1,3-dimethyl-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione 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 (Z)-7'-((1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-1,3-dimethyl-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione?
The CAS number of (Z)-7'-((1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-1,3-dimethyl-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione is 892627-01-9.
What is the molecular formula of (Z)-7'-((1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-1,3-dimethyl-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione?
The molecular formula of (Z)-7'-((1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-1,3-dimethyl-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione is C24H25N5O6.
What is the molecular weight of (Z)-7'-((1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-1,3-dimethyl-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione?
The molecular weight of (Z)-7'-((1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-1,3-dimethyl-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione is 479.18 g/mol.
Where can I buy (Z)-7'-((1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-1,3-dimethyl-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione?
You can request a quote for (Z)-7'-((1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-1,3-dimethyl-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-7'-((1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-1,3-dimethyl-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (Z)-7'-((1-ethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-1,3-dimethyl-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.