(E)-5-(anthracen-9-ylmethylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (E)-5-(anthracen-9-ylmethylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 372979-06-1) is a chemical compound with molecular formula C27H19FN2O3 and molecular weight 438.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-(anthracen-9-ylmethylidene)-1-[2-(4-fluorophenyl)ethyl]-1,3-diazinane-2,4,6-trione
Also Known As: (E)-5-(anthracen-9-ylmethylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione, 5-(anthracen-9-ylmethylidene)-1-[2-(4-fluorophenyl)ethyl]-1,3-diazinane-2,4,6-trione, (5E)-5-(anthracen-9-ylmethylidene)-1-[2-(4-fluorophenyl)ethyl]-1,3-diazinane-2,4,6-trione, (5E)-5-(anthracen-9-ylmethylidene)-1-[2-(4-fluorophenyl)ethyl]pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C27H19FN2O3 |
|---|---|
| Molecular Weight | 438.14 g/mol |
| LogP | 4.8366 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 438.13797 |
| Heavy Atoms | 33 |
| Complexity | 1403.7556 |
Chemical Identifiers
| CAS Number | 372979-06-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C3C=CC=CC3=C2/C=C/4\C(=O)NC(=O)N(C4=O)CCC5=CC=C(C=C5)F |
Product Overview
(E)-5-(anthracen-9-ylmethylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 372979-06-1), with molecular formula C27H19FN2O3 and molecular weight 438.14 g/mol. IUPAC: (5E)-5-(anthracen-9-ylmethylidene)-1-[2-(4-fluorophenyl)ethyl]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of (E)-5-(anthracen-9-ylmethylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (E)-5-(anthracen-9-ylmethylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 4.8366 indicates that (E)-5-(anthracen-9-ylmethylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-5-(anthracen-9-ylmethylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (E)-5-(anthracen-9-ylmethylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione has 1 hydrogen bond donor(s) and 3 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-(anthracen-9-ylmethylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (E)-5-(anthracen-9-ylmethylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 372979-06-1.
What is the molecular formula of (E)-5-(anthracen-9-ylmethylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (E)-5-(anthracen-9-ylmethylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione is C27H19FN2O3.
What is the molecular weight of (E)-5-(anthracen-9-ylmethylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (E)-5-(anthracen-9-ylmethylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 438.14 g/mol.
Where can I buy (E)-5-(anthracen-9-ylmethylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (E)-5-(anthracen-9-ylmethylene)-1-(4-fluorophenethyl)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)-5-(anthracen-9-ylmethylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-(anthracen-9-ylmethylene)-1-(4-fluorophenethyl)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.