(Z)-1-(4-bromophenyl)-5-(((5-(diethylamino)pentan-2-yl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (Z)-1-(4-bromophenyl)-5-(((5-(diethylamino)pentan-2-yl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 313953-53-6) is a chemical compound with molecular formula C20H27BrN4O3 and molecular weight 450.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromophenyl)-5-[5-(diethylamino)pentan-2-yliminomethyl]-6-hydroxypyrimidine-2,4-dione
Also Known As: (Z)-1-(4-bromophenyl)-5-(((5-(diethylamino)pentan-2-yl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione, (5Z)-1-(4-bromophenyl)-5-({[5-(diethylamino)pentan-2-yl]amino}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione, (5Z)-1-(4-bromophenyl)-5-[[5-(diethylamino)pentan-2-ylamino]methylidene]-1,3-diazinane-2,4,6-trione, 1-(4-bromophenyl)-5-({[4-(diethylamino)-1-methylbutyl]amino}methylene)-2,4,6(1H,3H,5H)-pyrimidinetrione, 1-(4-bromophenyl)-5-[(5-diethylaminopentan-2-ylamino)methylidene]-1,3-diazinane-2,4,6-trione
| Molecular Formula | C20H27BrN4O3 |
|---|---|
| Molecular Weight | 450.13 g/mol |
| LogP | 2.9233 |
| Topological Polar Surface Area | 90.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 450.12665 |
| Heavy Atoms | 28 |
| Complexity | 914.52856 |
Chemical Identifiers
| CAS Number | 313953-53-6 |
|---|---|
| SMILES | CCN(CC)CCCC(C)N=CC1=C(N(C(=O)NC1=O)C2=CC=C(C=C2)Br)O |
Product Overview
(Z)-1-(4-bromophenyl)-5-(((5-(diethylamino)pentan-2-yl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 313953-53-6), with molecular formula C20H27BrN4O3 and molecular weight 450.13 g/mol. IUPAC: 1-(4-bromophenyl)-5-[5-(diethylamino)pentan-2-yliminomethyl]-6-hydroxypyrimidine-2,4-dione.
Chemical Property Profile of (Z)-1-(4-bromophenyl)-5-(((5-(diethylamino)pentan-2-yl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (Z)-1-(4-bromophenyl)-5-(((5-(diethylamino)pentan-2-yl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 2.9233 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-1-(4-bromophenyl)-5-(((5-(diethylamino)pentan-2-yl)amino)methylene)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 (Z)-1-(4-bromophenyl)-5-(((5-(diethylamino)pentan-2-yl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (Z)-1-(4-bromophenyl)-5-(((5-(diethylamino)pentan-2-yl)amino)methylene)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 (Z)-1-(4-bromophenyl)-5-(((5-(diethylamino)pentan-2-yl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (Z)-1-(4-bromophenyl)-5-(((5-(diethylamino)pentan-2-yl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione is 313953-53-6.
What is the molecular formula of (Z)-1-(4-bromophenyl)-5-(((5-(diethylamino)pentan-2-yl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (Z)-1-(4-bromophenyl)-5-(((5-(diethylamino)pentan-2-yl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione is C20H27BrN4O3.
What is the molecular weight of (Z)-1-(4-bromophenyl)-5-(((5-(diethylamino)pentan-2-yl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (Z)-1-(4-bromophenyl)-5-(((5-(diethylamino)pentan-2-yl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione is 450.13 g/mol.
Where can I buy (Z)-1-(4-bromophenyl)-5-(((5-(diethylamino)pentan-2-yl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (Z)-1-(4-bromophenyl)-5-(((5-(diethylamino)pentan-2-yl)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 (Z)-1-(4-bromophenyl)-5-(((5-(diethylamino)pentan-2-yl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (Z)-1-(4-bromophenyl)-5-(((5-(diethylamino)pentan-2-yl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.