(E)-5-(1-((3-(1H-imidazol-1-yl)propyl)amino)propylidene)-1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (E)-5-(1-((3-(1H-imidazol-1-yl)propyl)amino)propylidene)-1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione (CAS 1164547-14-1) is a chemical compound with molecular formula C20H23N5O3 and molecular weight 381.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-5-[C-ethyl-N-(3-imidazol-1-ylpropyl)carbonimidoyl]-6-hydroxypyrimidine-2,4-dione
Also Known As: (E)-5-(1-((3-(1H-imidazol-1-yl)propyl)amino)propylidene)-1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione, (5E)-1-benzyl-5-[1-(3-imidazol-1-ylpropylamino)propylidene]-1,3-diazinane-2,4,6-trione, 1-Benzyl-5-[1-(3-imidazol-1-yl-propylamino)-prop-(E)-ylidene]-pyrimidine-2,4,6-trione, 1-benzyl-5-[1-(3-imidazol-1-ylpropylamino)propylidene]-1,3-diazinane-2,4,6-trione, (5E)-3-benzyl-6-hydroxy-5-(1-{[3-(1H-imidazol-1-yl)propyl]amino}propylidene)pyrimidine-2,4(3H,5H)-dione
| Molecular Formula | C20H23N5O3 |
|---|---|
| Molecular Weight | 381.18 g/mol |
| LogP | 1.7764 |
| Topological Polar Surface Area | 105.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 381.18008 |
| Heavy Atoms | 28 |
| Complexity | 1049.6903 |
Chemical Identifiers
| CAS Number | 1164547-14-1 |
|---|---|
| SMILES | CCC(=NCCCN1C=CN=C1)C2=C(N(C(=O)NC2=O)CC3=CC=CC=C3)O |
Product Overview
(E)-5-(1-((3-(1H-imidazol-1-yl)propyl)amino)propylidene)-1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione (CAS 1164547-14-1), with molecular formula C20H23N5O3 and molecular weight 381.18 g/mol. IUPAC: 1-benzyl-5-[C-ethyl-N-(3-imidazol-1-ylpropyl)carbonimidoyl]-6-hydroxypyrimidine-2,4-dione.
Chemical Property Profile of (E)-5-(1-((3-(1H-imidazol-1-yl)propyl)amino)propylidene)-1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (E)-5-(1-((3-(1H-imidazol-1-yl)propyl)amino)propylidene)-1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 1.7764 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-5-(1-((3-(1H-imidazol-1-yl)propyl)amino)propylidene)-1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione. The TPSA of 105.27 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-5-(1-((3-(1H-imidazol-1-yl)propyl)amino)propylidene)-1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (E)-5-(1-((3-(1H-imidazol-1-yl)propyl)amino)propylidene)-1-benzylpyrimidine-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)-5-(1-((3-(1H-imidazol-1-yl)propyl)amino)propylidene)-1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (E)-5-(1-((3-(1H-imidazol-1-yl)propyl)amino)propylidene)-1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione is 1164547-14-1.
What is the molecular formula of (E)-5-(1-((3-(1H-imidazol-1-yl)propyl)amino)propylidene)-1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (E)-5-(1-((3-(1H-imidazol-1-yl)propyl)amino)propylidene)-1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione is C20H23N5O3.
What is the molecular weight of (E)-5-(1-((3-(1H-imidazol-1-yl)propyl)amino)propylidene)-1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (E)-5-(1-((3-(1H-imidazol-1-yl)propyl)amino)propylidene)-1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione is 381.18 g/mol.
Where can I buy (E)-5-(1-((3-(1H-imidazol-1-yl)propyl)amino)propylidene)-1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (E)-5-(1-((3-(1H-imidazol-1-yl)propyl)amino)propylidene)-1-benzylpyrimidine-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-((3-(1H-imidazol-1-yl)propyl)amino)propylidene)-1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-(1-((3-(1H-imidazol-1-yl)propyl)amino)propylidene)-1-benzylpyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.