)-trione
TL;DR: )-trione (CAS 892618-82-5) is a chemical compound with molecular formula C25H28N6O7 and molecular weight 524.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7'-[[6-hydroxy-1-(2-methoxyethyl)-2,4-dioxopyrimidin-5-yl]methylideneamino]-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: )-trione, (Z)-7'-(((1-(2-methoxyethyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)-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)-[4-hydroxy-1-(2-methoxyethyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}amino)-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, 7'-[[1-(2-methoxyethyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methylamino]-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 | C25H28N6O7 |
|---|---|
| Molecular Weight | 524.20 g/mol |
| LogP | 0.2009 |
| Topological Polar Surface Area | 157.61 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 524.20197 |
| Heavy Atoms | 38 |
| Complexity | 1467.9951 |
Chemical Identifiers
| CAS Number | 892618-82-5 |
|---|---|
| SMILES | CN1C(=O)C2(CC3=C(C=CC(=C3)N=CC4=C(N(C(=O)NC4=O)CCOC)O)N5C2CCC5)C(=O)N(C1=O)C |
Product Overview
)-trione (CAS 892618-82-5), with molecular formula C25H28N6O7 and molecular weight 524.20 g/mol. IUPAC: 7'-[[6-hydroxy-1-(2-methoxyethyl)-2,4-dioxopyrimidin-5-yl]methylideneamino]-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 )-trione
Property Insights of )-trione
The XLogP value of 0.2009 suggests moderate lipophilicity, balancing water solubility and membrane permeability for )-trione. The TPSA of 157.61 Ų indicates high polarity, suggesting )-trione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, )-trione has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of )-trione?
The CAS number of )-trione is 892618-82-5.
What is the molecular formula of )-trione?
The molecular formula of )-trione is C25H28N6O7.
What is the molecular weight of )-trione?
The molecular weight of )-trione is 524.20 g/mol.
Where can I buy )-trione?
You can request a quote for )-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for )-trione?
Yes, KEHONG BIO provides custom synthesis services for )-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.