(E)-1-allyl-5-(1-((1-benzylpiperidin-4-yl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (E)-1-allyl-5-(1-((1-benzylpiperidin-4-yl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 843632-63-3) is a chemical compound with molecular formula C22H28N4O3 and molecular weight 396.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[N-(1-benzylpiperidin-4-yl)-C-ethylcarbonimidoyl]-6-hydroxy-1-prop-2-enylpyrimidine-2,4-dione
Also Known As: (E)-1-allyl-5-(1-((1-benzylpiperidin-4-yl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione, 5-[1-[(1-benzyl-4-piperidyl)amino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione, (5E)-5-[1-[(1-benzylpiperidin-4-yl)amino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione, 5-[1-[(1-benzylpiperidin-4-yl)amino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione
| Molecular Formula | C22H28N4O3 |
|---|---|
| Molecular Weight | 396.22 g/mol |
| LogP | 2.2919 |
| Topological Polar Surface Area | 90.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 396.21616 |
| Heavy Atoms | 29 |
| Complexity | 983.35236 |
Chemical Identifiers
| CAS Number | 843632-63-3 |
|---|---|
| SMILES | CCC(=NC1CCN(CC1)CC2=CC=CC=C2)C3=C(N(C(=O)NC3=O)CC=C)O |
Product Overview
(E)-1-allyl-5-(1-((1-benzylpiperidin-4-yl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 843632-63-3), with molecular formula C22H28N4O3 and molecular weight 396.22 g/mol. IUPAC: 5-[N-(1-benzylpiperidin-4-yl)-C-ethylcarbonimidoyl]-6-hydroxy-1-prop-2-enylpyrimidine-2,4-dione.
Chemical Property Profile of (E)-1-allyl-5-(1-((1-benzylpiperidin-4-yl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (E)-1-allyl-5-(1-((1-benzylpiperidin-4-yl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 2.2919 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-1-allyl-5-(1-((1-benzylpiperidin-4-yl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione. The TPSA of 90.69 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-1-allyl-5-(1-((1-benzylpiperidin-4-yl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (E)-1-allyl-5-(1-((1-benzylpiperidin-4-yl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-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 (E)-1-allyl-5-(1-((1-benzylpiperidin-4-yl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (E)-1-allyl-5-(1-((1-benzylpiperidin-4-yl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione is 843632-63-3.
What is the molecular formula of (E)-1-allyl-5-(1-((1-benzylpiperidin-4-yl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (E)-1-allyl-5-(1-((1-benzylpiperidin-4-yl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione is C22H28N4O3.
What is the molecular weight of (E)-1-allyl-5-(1-((1-benzylpiperidin-4-yl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (E)-1-allyl-5-(1-((1-benzylpiperidin-4-yl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione is 396.22 g/mol.
Where can I buy (E)-1-allyl-5-(1-((1-benzylpiperidin-4-yl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (E)-1-allyl-5-(1-((1-benzylpiperidin-4-yl)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-((1-benzylpiperidin-4-yl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (E)-1-allyl-5-(1-((1-benzylpiperidin-4-yl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.