![6'-chloro-1,3-dimethyl-7'-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione structure](/static/products/892/892619-70-4.png)
6'-chloro-1,3-dimethyl-7'-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione
TL;DR: 6'-chloro-1,3-dimethyl-7'-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione (CAS 892619-70-4) is a chemical compound with molecular formula C22H20ClN5O6 and molecular weight 485.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6'-chloro-1,3-dimethyl-7'-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]spiro[1,3-diazinane-5,4'-2,3,3a,5-tetrahydro-1H-pyrrolo[1,2-a]quinoline]-2,4,6-trione
Also Known As: 6'-chloro-1,3-dimethyl-7'-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione, 6'-chloro-1,3-dimethyl-7'-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]spiro[1,3-diazinane-5,4'-2,3,3a,5-tetrahydro-1H-pyrrolo[1,2-a]quinoline]-2,4,6-trione, 6'-chloro-7'-[(E)-(2,6-dihydroxy-4-oxopyrimidin-5(4H)-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 | C22H20ClN5O6 |
|---|---|
| Molecular Weight | 485.11 g/mol |
| LogP | 0.6511 |
| Topological Polar Surface Area | 136.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 485.1102 |
| Heavy Atoms | 34 |
| Complexity | 1210.417 |
Chemical Identifiers
| CAS Number | 892619-70-4 |
|---|---|
| SMILES | CN1C(=O)C2(CC3=C(C=CC(=C3Cl)C=C4C(=O)NC(=O)NC4=O)N5C2CCC5)C(=O)N(C1=O)C |
Product Overview
6'-chloro-1,3-dimethyl-7'-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione (CAS 892619-70-4), with molecular formula C22H20ClN5O6 and molecular weight 485.11 g/mol. IUPAC: 6'-chloro-1,3-dimethyl-7'-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]spiro[1,3-diazinane-5,4'-2,3,3a,5-tetrahydro-1H-pyrrolo[1,2-a]quinoline]-2,4,6-trione.
Chemical Property Profile of 6'-chloro-1,3-dimethyl-7'-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-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 6'-chloro-1,3-dimethyl-7'-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-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 0.6511 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6'-chloro-1,3-dimethyl-7'-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-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 136.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 6'-chloro-1,3-dimethyl-7'-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-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, 6'-chloro-1,3-dimethyl-7'-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione has 2 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 6'-chloro-1,3-dimethyl-7'-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-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 6'-chloro-1,3-dimethyl-7'-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione is 892619-70-4.
What is the molecular formula of 6'-chloro-1,3-dimethyl-7'-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-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 6'-chloro-1,3-dimethyl-7'-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione is C22H20ClN5O6.
What is the molecular weight of 6'-chloro-1,3-dimethyl-7'-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-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 6'-chloro-1,3-dimethyl-7'-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-2',3',3a',5'-tetrahydro-1H,1'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4,6(3H)-trione is 485.11 g/mol.
Where can I buy 6'-chloro-1,3-dimethyl-7'-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-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 6'-chloro-1,3-dimethyl-7'-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-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 6'-chloro-1,3-dimethyl-7'-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-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 6'-chloro-1,3-dimethyl-7'-((2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-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.