(E)-1-cycloheptyl-5-(((4-fluorobenzyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (E)-1-cycloheptyl-5-(((4-fluorobenzyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 1164524-55-3) is a chemical compound with molecular formula C19H22FN3O3 and molecular weight 359.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cycloheptyl-5-[(4-fluorophenyl)methyliminomethyl]-6-hydroxypyrimidine-2,4-dione
Also Known As: (E)-1-cycloheptyl-5-(((4-fluorobenzyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione, 1-cycloheptyl-5-[[(4-fluorophenyl)methylamino]methylidene]-1,3-diazinane-2,4,6-trione, (5E)-1-cycloheptyl-5-[[(4-fluorophenyl)methylamino]methylidene]-1,3-diazinane-2,4,6-trione, (5E)-3-cycloheptyl-5-{[(4-fluorobenzyl)amino]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
| Molecular Formula | C19H22FN3O3 |
|---|---|
| Molecular Weight | 359.16 g/mol |
| LogP | 2.8957 |
| Topological Polar Surface Area | 87.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 359.16452 |
| Heavy Atoms | 26 |
| Complexity | 891.7258 |
Chemical Identifiers
| CAS Number | 1164524-55-3 |
|---|---|
| SMILES | C1CCCC(CC1)N2C(=C(C(=O)NC2=O)C=NCC3=CC=C(C=C3)F)O |
Product Overview
(E)-1-cycloheptyl-5-(((4-fluorobenzyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 1164524-55-3), with molecular formula C19H22FN3O3 and molecular weight 359.16 g/mol. IUPAC: 1-cycloheptyl-5-[(4-fluorophenyl)methyliminomethyl]-6-hydroxypyrimidine-2,4-dione.
Chemical Property Profile of (E)-1-cycloheptyl-5-(((4-fluorobenzyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (E)-1-cycloheptyl-5-(((4-fluorobenzyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 2.8957 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-1-cycloheptyl-5-(((4-fluorobenzyl)amino)methylene)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 (E)-1-cycloheptyl-5-(((4-fluorobenzyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (E)-1-cycloheptyl-5-(((4-fluorobenzyl)amino)methylene)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 (E)-1-cycloheptyl-5-(((4-fluorobenzyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (E)-1-cycloheptyl-5-(((4-fluorobenzyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione is 1164524-55-3.
What is the molecular formula of (E)-1-cycloheptyl-5-(((4-fluorobenzyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (E)-1-cycloheptyl-5-(((4-fluorobenzyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione is C19H22FN3O3.
What is the molecular weight of (E)-1-cycloheptyl-5-(((4-fluorobenzyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (E)-1-cycloheptyl-5-(((4-fluorobenzyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione is 359.16 g/mol.
Where can I buy (E)-1-cycloheptyl-5-(((4-fluorobenzyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (E)-1-cycloheptyl-5-(((4-fluorobenzyl)amino)methylene)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-cycloheptyl-5-(((4-fluorobenzyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (E)-1-cycloheptyl-5-(((4-fluorobenzyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.