5'-[5-(dimethylaminomethyl)-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione structure

5'-[5-(dimethylaminomethyl)-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione

TL;DR: 5'-[5-(dimethylaminomethyl)-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione (CAS 895909-09-8) is a chemical compound with molecular formula C26H31N5O9 and molecular weight 557.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

5'-[5-[(dimethylamino)methyl]-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione

Also Known As: 5'-[5-(dimethylaminomethyl)-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione, 5-(5-((dimethylamino)methyl)-1,3-dimethyl-2,4,6-trioxohexahydropyrimidin-5-yl)-4-methoxy-1',3'-dimethyl-7,8-dihydro-1'H,5H-spiro[naphtho[2,3-d][1,3]dioxole-6,5'-pyrimidine]-2',4',6'(3'H)-trione, 5-{5-[(dimethylamino)methyl]-1,3-dimethyl-2,4,6-trioxohexahydropyrimidin-5-yl}-4-methoxy-1',3'-dimethyl-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

CAS: 895909-09-8
Molecular Formula C26H31N5O9
Molecular Weight 557.21 g/mol
LogP 0.0889
Topological Polar Surface Area 146.31 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 10
Rotatable Bonds 4
Exact Mass 557.21216
Heavy Atoms 40
Complexity 1340.763

Chemical Identifiers

CAS Number 895909-09-8
SMILES CN1C(=O)C2(CCC3=CC4=C(C(=C3C2C5(C(=O)N(C(=O)N(C5=O)C)C)CN(C)C)OC)OCO4)C(=O)N(C1=O)C

Product Overview

5'-[5-(dimethylaminomethyl)-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione (CAS 895909-09-8), with molecular formula C26H31N5O9 and molecular weight 557.21 g/mol. IUPAC: 5'-[5-[(dimethylamino)methyl]-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione.

🧪
Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →

Chemical Property Profile of 5'-[5-(dimethylaminomethyl)-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione

XLogP
0.0889
TPSA (Topological Polar Surface Area)
146.31
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
10
Rotatable Bonds
4
Heavy Atoms
40
Complexity
1340.763
Exact Mass
557.21216
Monoisotopic Mass
557.21216
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 5'-[5-(dimethylaminomethyl)-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione

The XLogP value of 0.0889 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5'-[5-(dimethylaminomethyl)-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione. The TPSA of 146.31 Ų indicates high polarity, suggesting 5'-[5-(dimethylaminomethyl)-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[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'-[5-(dimethylaminomethyl)-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[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 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of 5'-[5-(dimethylaminomethyl)-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione?

The CAS number of 5'-[5-(dimethylaminomethyl)-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione is 895909-09-8.

What is the molecular formula of 5'-[5-(dimethylaminomethyl)-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione?

The molecular formula of 5'-[5-(dimethylaminomethyl)-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione is C26H31N5O9.

What is the molecular weight of 5'-[5-(dimethylaminomethyl)-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione?

The molecular weight of 5'-[5-(dimethylaminomethyl)-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[1,3-diazinane-5,6'-7,8-dihydro-5H-benzo[f][1,3]benzodioxole]-2,4,6-trione is 557.21 g/mol.

Where can I buy 5'-[5-(dimethylaminomethyl)-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[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'-[5-(dimethylaminomethyl)-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[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'-[5-(dimethylaminomethyl)-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[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'-[5-(dimethylaminomethyl)-1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl]-4'-methoxy-1,3-dimethylspiro[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.

🤖 科弘生物 AI 助手 ×
您好!我是 科弘生物 AI 助手。可以问我产品搜索、询价、样品或技术问题。如何帮助您?