7'-((2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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: 7'-((2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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 904262-83-5) is a chemical compound with molecular formula C27H29N3O7 and molecular weight 507.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7'-[(2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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: 7'-((2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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'-[(2,4-dioxo-1,5-dioxaspiro[5.5]undec-3-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, 7'-[(8,10-dioxo-7,11-dioxaspiro[5.5]undecan-9-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
| Molecular Formula | C27H29N3O7 |
|---|---|
| Molecular Weight | 507.20 g/mol |
| LogP | 2.3921 |
| Topological Polar Surface Area | 113.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 1 |
| Exact Mass | 507.20056 |
| Heavy Atoms | 37 |
| Complexity | 1232.542 |
Chemical Identifiers
| CAS Number | 904262-83-5 |
|---|---|
| SMILES | CN1C(=O)C2(CC3=C(C=CC(=C3)C=C4C(=O)OC5(CCCCC5)OC4=O)N6C2CCC6)C(=O)N(C1=O)C |
Product Overview
7'-((2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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 904262-83-5), with molecular formula C27H29N3O7 and molecular weight 507.20 g/mol. IUPAC: 7'-[(2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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 7'-((2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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 7'-((2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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 2.3921 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7'-((2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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 113.53 Ų falls within the moderate polarity range, balancing permeability and solubility for 7'-((2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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, 7'-((2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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 0 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 7'-((2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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 7'-((2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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 904262-83-5.
What is the molecular formula of 7'-((2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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 7'-((2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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 C27H29N3O7.
What is the molecular weight of 7'-((2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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 7'-((2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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 507.20 g/mol.
Where can I buy 7'-((2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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 7'-((2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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 7'-((2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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 7'-((2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-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.