(E)-1-allyl-5-(1-((3-aminophenyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (E)-1-allyl-5-(1-((3-aminophenyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 573929-97-2) is a chemical compound with molecular formula C16H18N4O3 and molecular weight 314.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[N-(3-aminophenyl)-C-ethylcarbonimidoyl]-6-hydroxy-1-prop-2-enylpyrimidine-2,4-dione
Also Known As: (E)-1-allyl-5-(1-((3-aminophenyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione, (5E)-5-[1-(3-aminoanilino)propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione, 5-[1-(3-aminoanilino)propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione, (5E)-5-{1-[(3-aminophenyl)amino]propylidene}-6-hydroxy-3-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
| Molecular Formula | C16H18N4O3 |
|---|---|
| Molecular Weight | 314.14 g/mol |
| LogP | 1.5412 |
| Topological Polar Surface Area | 113.47 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 314.13788 |
| Heavy Atoms | 23 |
| Complexity | 877.6246 |
Chemical Identifiers
| CAS Number | 573929-97-2 |
|---|---|
| SMILES | CCC(=NC1=CC=CC(=C1)N)C2=C(N(C(=O)NC2=O)CC=C)O |
Product Overview
(E)-1-allyl-5-(1-((3-aminophenyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 573929-97-2), with molecular formula C16H18N4O3 and molecular weight 314.14 g/mol. IUPAC: 5-[N-(3-aminophenyl)-C-ethylcarbonimidoyl]-6-hydroxy-1-prop-2-enylpyrimidine-2,4-dione.
Chemical Property Profile of (E)-1-allyl-5-(1-((3-aminophenyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (E)-1-allyl-5-(1-((3-aminophenyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 1.5412 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-1-allyl-5-(1-((3-aminophenyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione. The TPSA of 113.47 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-1-allyl-5-(1-((3-aminophenyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (E)-1-allyl-5-(1-((3-aminophenyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione has 3 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 (E)-1-allyl-5-(1-((3-aminophenyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (E)-1-allyl-5-(1-((3-aminophenyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione is 573929-97-2.
What is the molecular formula of (E)-1-allyl-5-(1-((3-aminophenyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (E)-1-allyl-5-(1-((3-aminophenyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione is C16H18N4O3.
What is the molecular weight of (E)-1-allyl-5-(1-((3-aminophenyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (E)-1-allyl-5-(1-((3-aminophenyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione is 314.14 g/mol.
Where can I buy (E)-1-allyl-5-(1-((3-aminophenyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (E)-1-allyl-5-(1-((3-aminophenyl)amino)propylidene)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)-1-allyl-5-(1-((3-aminophenyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (E)-1-allyl-5-(1-((3-aminophenyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.