(Z)-1-butyl-5-(1-(phenethylamino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (Z)-1-butyl-5-(1-(phenethylamino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 1164541-23-4) is a chemical compound with molecular formula C18H23N3O3 and molecular weight 329.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-6-hydroxy-5-[C-methyl-N-(2-phenylethyl)carbonimidoyl]pyrimidine-2,4-dione
Also Known As: (Z)-1-butyl-5-(1-(phenethylamino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione, 1-butyl-5-[1-(phenethylamino)ethylidene]-1,3-diazinane-2,4,6-trione, (5Z)-1-butyl-5-[1-(phenethylamino)ethylidene]-1,3-diazinane-2,4,6-trione, (5Z)-3-butyl-6-hydroxy-5-{1-[(2-phenylethyl)amino]ethylidene}pyrimidine-2,4(3H,5H)-dione
| Molecular Formula | C18H23N3O3 |
|---|---|
| Molecular Weight | 329.17 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 82.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 329.17395 |
| Heavy Atoms | 24 |
| Complexity | 534.0 |
Chemical Identifiers
| CAS Number | 1164541-23-4 |
|---|---|
| SMILES | CCCCN1C(=C(C(=O)NC1=O)C(=NCCC2=CC=CC=C2)C)O |
| InChIKey | AYCPHDRFIRLBNG-UHFFFAOYSA-N |
Product Overview
(Z)-1-butyl-5-(1-(phenethylamino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 1164541-23-4), with molecular formula C18H23N3O3 and molecular weight 329.17 g/mol. IUPAC: 1-butyl-6-hydroxy-5-[C-methyl-N-(2-phenylethyl)carbonimidoyl]pyrimidine-2,4-dione.
Chemical Property Profile of (Z)-1-butyl-5-(1-(phenethylamino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (Z)-1-butyl-5-(1-(phenethylamino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-1-butyl-5-(1-(phenethylamino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione. The TPSA of 82.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-1-butyl-5-(1-(phenethylamino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (Z)-1-butyl-5-(1-(phenethylamino)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-butyl-5-(1-(phenethylamino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (Z)-1-butyl-5-(1-(phenethylamino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione is 1164541-23-4.
What is the molecular formula of (Z)-1-butyl-5-(1-(phenethylamino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (Z)-1-butyl-5-(1-(phenethylamino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione is C18H23N3O3.
What is the molecular weight of (Z)-1-butyl-5-(1-(phenethylamino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (Z)-1-butyl-5-(1-(phenethylamino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione is 329.17 g/mol.
Where can I buy (Z)-1-butyl-5-(1-(phenethylamino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (Z)-1-butyl-5-(1-(phenethylamino)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-butyl-5-(1-(phenethylamino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (Z)-1-butyl-5-(1-(phenethylamino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.