![5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione structure](/static/products/858/858740-50-8.png)
5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione
TL;DR: 5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione (CAS 858740-50-8) is a chemical compound with molecular formula C27H32N4O9 and molecular weight 556.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione
Also Known As: 5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione, 5-(1,3-diethyl-2,4,6-trioxohexahydropyrimidin-5-yl)-1',3'-diethyl-4-methoxy-7,8-dihydro-1'H,5H-spiro[naphtho[2,3-d][1,3]dioxole-6,5'-pyrimidine]-2',4',6'(3'H)-trione, 5-(1,3-diethyl-2,4,6-trioxohexahydropyrimidin-5-yl)-1',3'-diethyl-4-methoxy-7,8-dihydro-2'H,5H-spiro[naphtho[2,3-d][1,3]dioxole-6,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
| Molecular Formula | C27H32N4O9 |
|---|---|
| Molecular Weight | 556.22 g/mol |
| LogP | 1.7175 |
| Topological Polar Surface Area | 143.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 556.2169 |
| Heavy Atoms | 40 |
| Complexity | 1289.4904 |
Chemical Identifiers
| CAS Number | 858740-50-8 |
|---|---|
| SMILES | CCN1C(=O)C(C(=O)N(C1=O)CC)C2C3=C(C4=C(C=C3CCC25C(=O)N(C(=O)N(C5=O)CC)CC)OCO4)OC |
Product Overview
5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione (CAS 858740-50-8), with molecular formula C27H32N4O9 and molecular weight 556.22 g/mol. IUPAC: 5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione.
Chemical Property Profile of 5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione
Property Insights of 5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione
The XLogP value of 1.7175 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione. The TPSA of 143.07 Ų indicates high polarity, suggesting 5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione has 0 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 5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione?
The CAS number of 5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione is 858740-50-8.
What is the molecular formula of 5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione?
The molecular formula of 5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione is C27H32N4O9.
What is the molecular weight of 5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione?
The molecular weight of 5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione is 556.22 g/mol.
Where can I buy 5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione?
You can request a quote for 5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 5'-(1,3-diethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-1,3-diethyl-4'-methoxyspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.