(E)-5-(1-(hexylamino)ethylidene)-1-(o-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (E)-5-(1-(hexylamino)ethylidene)-1-(o-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 843620-22-4) is a chemical compound with molecular formula C19H25N3O3 and molecular weight 343.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(N-hexyl-C-methylcarbonimidoyl)-6-hydroxy-1-(2-methylphenyl)pyrimidine-2,4-dione
Also Known As: 5-[1-(hexylamino)ethylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione, (E)-5-(1-(hexylamino)ethylidene)-1-(o-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione, (5E)-5-[1-(hexylamino)ethylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione, (5E)-5-[1-(hexylamino)ethylidene]-6-hydroxy-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione
| Molecular Formula | C19H25N3O3 |
|---|---|
| Molecular Weight | 343.19 g/mol |
| LogP | 2.92912 |
| Topological Polar Surface Area | 87.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 343.1896 |
| Heavy Atoms | 25 |
| Complexity | 878.21356 |
Chemical Identifiers
| CAS Number | 843620-22-4 |
|---|---|
| SMILES | CCCCCCN=C(C)C1=C(N(C(=O)NC1=O)C2=CC=CC=C2C)O |
Product Overview
(E)-5-(1-(hexylamino)ethylidene)-1-(o-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 843620-22-4), with molecular formula C19H25N3O3 and molecular weight 343.19 g/mol. IUPAC: 5-(N-hexyl-C-methylcarbonimidoyl)-6-hydroxy-1-(2-methylphenyl)pyrimidine-2,4-dione.
Chemical Property Profile of (E)-5-(1-(hexylamino)ethylidene)-1-(o-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (E)-5-(1-(hexylamino)ethylidene)-1-(o-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 2.92912 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-5-(1-(hexylamino)ethylidene)-1-(o-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione. The TPSA of 87.45 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-5-(1-(hexylamino)ethylidene)-1-(o-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (E)-5-(1-(hexylamino)ethylidene)-1-(o-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione has 2 hydrogen bond donor(s) and 4 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 (E)-5-(1-(hexylamino)ethylidene)-1-(o-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (E)-5-(1-(hexylamino)ethylidene)-1-(o-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 843620-22-4.
What is the molecular formula of (E)-5-(1-(hexylamino)ethylidene)-1-(o-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (E)-5-(1-(hexylamino)ethylidene)-1-(o-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione is C19H25N3O3.
What is the molecular weight of (E)-5-(1-(hexylamino)ethylidene)-1-(o-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (E)-5-(1-(hexylamino)ethylidene)-1-(o-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 343.19 g/mol.
Where can I buy (E)-5-(1-(hexylamino)ethylidene)-1-(o-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (E)-5-(1-(hexylamino)ethylidene)-1-(o-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-5-(1-(hexylamino)ethylidene)-1-(o-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-(1-(hexylamino)ethylidene)-1-(o-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.