![1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-2,4,6-trione structure](/static/products/116/1164553-83-6.png)
1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-2,4,6-trione
TL;DR: 1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-2,4,6-trione (CAS 1164553-83-6) is a chemical compound with molecular formula C18H21N3O4 and molecular weight 343.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-5-[C-methyl-N-(oxolan-2-ylmethyl)carbonimidoyl]-1-(4-methylphenyl)pyrimidine-2,4-dione
Also Known As: 1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-2,4,6-trione, (5E)-1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-2,4,6-trione, (5E)-6-hydroxy-3-(4-methylphenyl)-5-{1-[(tetrahydrofuran-2-ylmethyl)amino]ethylidene}pyrimidine-2,4(3H,5H)-dione, (E)-5-(1-(((tetrahydrofuran-2-yl)methyl)amino)ethylidene)-1-(p-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione, 5-[1-[(Tetrahydro-furan-2-ylmethyl)-amino]-eth-(E)-ylidene]-1-p-tolyl-pyrimidine-2,4,6-trione
| Molecular Formula | C18H21N3O4 |
|---|---|
| Molecular Weight | 343.15 g/mol |
| LogP | 1.52782 |
| Topological Polar Surface Area | 96.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.1532 |
| Heavy Atoms | 25 |
| Complexity | 903.3989 |
Chemical Identifiers
| CAS Number | 1164553-83-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=C(C(=O)NC2=O)C(=NCC3CCCO3)C)O |
Product Overview
1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-2,4,6-trione (CAS 1164553-83-6), with molecular formula C18H21N3O4 and molecular weight 343.15 g/mol. IUPAC: 6-hydroxy-5-[C-methyl-N-(oxolan-2-ylmethyl)carbonimidoyl]-1-(4-methylphenyl)pyrimidine-2,4-dione.
Chemical Property Profile of 1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-2,4,6-trione
Property Insights of 1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-2,4,6-trione
The XLogP value of 1.52782 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-2,4,6-trione. The TPSA of 96.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-2,4,6-trione has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-2,4,6-trione?
The CAS number of 1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-2,4,6-trione is 1164553-83-6.
What is the molecular formula of 1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-2,4,6-trione?
The molecular formula of 1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-2,4,6-trione is C18H21N3O4.
What is the molecular weight of 1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-2,4,6-trione?
The molecular weight of 1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-2,4,6-trione is 343.15 g/mol.
Where can I buy 1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-2,4,6-trione?
You can request a quote for 1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-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 1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-methylphenyl)-5-[1-(oxolan-2-ylmethylamino)ethylidene]-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.