RefChem:442820
TL;DR: RefChem:442820 (CAS 55894-21-8) is a chemical compound with molecular formula C25H34N4O10 and molecular weight 550.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[5-[1,3-bis(2-methoxyethyl)-2,4,6-trioxo-1,3-diazinan-5-yl]penta-2,4-dienylidene]-1,3-bis(2-methoxyethyl)-1,3-diazinane-2,4,6-trione
Also Known As: HISHICOLIN PX-4ALB, 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(5-(hexahydro-1,3-bis(2-methoxyethyl)-2,4,6-trioxo-5-pyrimidinyl)-2,4-pentadienylidene)-1,3-bis(2-methoxyethyl)-, 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(5-(hexahydro-1,3-bis(2-methoxyethyl)-2,4,6-trioxo-5-pyrimidinyl)-2,4-pentadien-1-ylidene)-1,3-bis(2-methoxyethyl)-, 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-[5-[hexahydro-1,3-bis(2-methoxyethyl)-2,4,6-trioxo-5-pyrimidinyl]-2,4-pentadien-1-ylidene]-1,3-bis(2-methoxyethyl)-, 5-[5-[1,3-bis(2-methoxyethyl)-2,4,6-trioxo-1,3-diazinan-5-yl]penta-2,4-dienylidene]-1,3-bis(2-methoxyethyl)-1,3-diazinane-2,4,6-trione
| Molecular Formula | C25H34N4O10 |
|---|---|
| Molecular Weight | 550.23 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 152.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 15 |
| Exact Mass | 550.2275 |
| Heavy Atoms | 39 |
| Complexity | 976.0 |
Chemical Identifiers
| CAS Number | 55894-21-8 |
|---|---|
| SMILES | COCCN1C(=O)C(C(=O)N(C1=O)CCOC)C=CC=CC=C2C(=O)N(C(=O)N(C2=O)CCOC)CCOC |
| InChIKey | AFGOEELRPFHCOT-UHFFFAOYSA-N |
Product Overview
RefChem:442820 (CAS 55894-21-8), with molecular formula C25H34N4O10 and molecular weight 550.23 g/mol. IUPAC: 5-[5-[1,3-bis(2-methoxyethyl)-2,4,6-trioxo-1,3-diazinan-5-yl]penta-2,4-dienylidene]-1,3-bis(2-methoxyethyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of RefChem:442820
Property Insights of RefChem:442820
The XLogP value of -0.6 indicates that RefChem:442820 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 152.0 Ų indicates high polarity, suggesting RefChem:442820 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:442820 has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:442820?
The CAS number of RefChem:442820 is 55894-21-8.
What is the molecular formula of RefChem:442820?
The molecular formula of RefChem:442820 is C25H34N4O10.
What is the molecular weight of RefChem:442820?
The molecular weight of RefChem:442820 is 550.23 g/mol.
Where can I buy RefChem:442820?
You can request a quote for RefChem:442820 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:442820?
Yes, KEHONG BIO provides custom synthesis services for RefChem:442820 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.