(Z)-1-allyl-5-(1-((1-phenylethyl)amino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (Z)-1-allyl-5-(1-((1-phenylethyl)amino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 587010-45-5) is a chemical compound with molecular formula C17H19N3O3 and molecular weight 313.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-5-[C-methyl-N-(1-phenylethyl)carbonimidoyl]-1-prop-2-enylpyrimidine-2,4-dione
Also Known As: (Z)-1-allyl-5-(1-((1-phenylethyl)amino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione, 5-[1-(1-phenylethylamino)ethylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione, (5Z)-5-[1-(1-phenylethylamino)ethylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione, 1-Allyl-5-[1-(1-phenyl-ethylamino)-eth-(Z)-ylidene]-pyrimidine-2,4,6-trione, (5Z)-6-hydroxy-5-{1-[(1-phenylethyl)amino]ethylidene}-3-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
| Molecular Formula | C17H19N3O3 |
|---|---|
| Molecular Weight | 313.14 g/mol |
| LogP | 1.9984 |
| Topological Polar Surface Area | 87.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 313.14264 |
| Heavy Atoms | 23 |
| Complexity | 847.6227 |
Chemical Identifiers
| CAS Number | 587010-45-5 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)N=C(C)C2=C(N(C(=O)NC2=O)CC=C)O |
Product Overview
(Z)-1-allyl-5-(1-((1-phenylethyl)amino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 587010-45-5), with molecular formula C17H19N3O3 and molecular weight 313.14 g/mol. IUPAC: 6-hydroxy-5-[C-methyl-N-(1-phenylethyl)carbonimidoyl]-1-prop-2-enylpyrimidine-2,4-dione.
Chemical Property Profile of (Z)-1-allyl-5-(1-((1-phenylethyl)amino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (Z)-1-allyl-5-(1-((1-phenylethyl)amino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 1.9984 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-1-allyl-5-(1-((1-phenylethyl)amino)ethylidene)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 (Z)-1-allyl-5-(1-((1-phenylethyl)amino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (Z)-1-allyl-5-(1-((1-phenylethyl)amino)ethylidene)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 (Z)-1-allyl-5-(1-((1-phenylethyl)amino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (Z)-1-allyl-5-(1-((1-phenylethyl)amino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione is 587010-45-5.
What is the molecular formula of (Z)-1-allyl-5-(1-((1-phenylethyl)amino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (Z)-1-allyl-5-(1-((1-phenylethyl)amino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione is C17H19N3O3.
What is the molecular weight of (Z)-1-allyl-5-(1-((1-phenylethyl)amino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (Z)-1-allyl-5-(1-((1-phenylethyl)amino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione is 313.14 g/mol.
Where can I buy (Z)-1-allyl-5-(1-((1-phenylethyl)amino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (Z)-1-allyl-5-(1-((1-phenylethyl)amino)ethylidene)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 (Z)-1-allyl-5-(1-((1-phenylethyl)amino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (Z)-1-allyl-5-(1-((1-phenylethyl)amino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.