(E)-2-(2-(benzyloxy)-4-(diethylamino)styryl)-6-hydroxy-5-nitropyrimidin-4(3H)-one
TL;DR: (E)-2-(2-(benzyloxy)-4-(diethylamino)styryl)-6-hydroxy-5-nitropyrimidin-4(3H)-one (CAS 708994-87-0) is a chemical compound with molecular formula C23H24N4O5 and molecular weight 436.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(E)-2-[4-(diethylamino)-2-phenylmethoxyphenyl]ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one
Also Known As: (E)-2-(2-(benzyloxy)-4-(diethylamino)styryl)-6-hydroxy-5-nitropyrimidin-4(3H)-one, 2-[2-(4-diethylamino-2-phenylmethoxy-phenyl)ethenyl]-6-hydroxy-5-nitro-3H-pyrimidin-4-one, 2-{(E)-2-[2-(benzyloxy)-4-(diethylamino)phenyl]ethenyl}-5-nitropyrimidine-4,6-diol, 2-[(E)-2-[4-(diethylamino)-2-phenylmethoxyphenyl]ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one
| Molecular Formula | C23H24N4O5 |
|---|---|
| Molecular Weight | 436.17 g/mol |
| LogP | 3.9793 |
| Topological Polar Surface Area | 121.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 436.17468 |
| Heavy Atoms | 32 |
| Complexity | 1170.7494 |
Chemical Identifiers
| CAS Number | 708994-87-0 |
|---|---|
| SMILES | CCN(CC)C1=CC(=C(C=C1)/C=C/C2=NC(=C(C(=O)N2)[N+](=O)[O-])O)OCC3=CC=CC=C3 |
Product Overview
(E)-2-(2-(benzyloxy)-4-(diethylamino)styryl)-6-hydroxy-5-nitropyrimidin-4(3H)-one (CAS 708994-87-0), with molecular formula C23H24N4O5 and molecular weight 436.17 g/mol. IUPAC: 2-[(E)-2-[4-(diethylamino)-2-phenylmethoxyphenyl]ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one.
Chemical Property Profile of (E)-2-(2-(benzyloxy)-4-(diethylamino)styryl)-6-hydroxy-5-nitropyrimidin-4(3H)-one
Property Insights of (E)-2-(2-(benzyloxy)-4-(diethylamino)styryl)-6-hydroxy-5-nitropyrimidin-4(3H)-one
The XLogP value of 3.9793 indicates that (E)-2-(2-(benzyloxy)-4-(diethylamino)styryl)-6-hydroxy-5-nitropyrimidin-4(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.59 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-(2-(benzyloxy)-4-(diethylamino)styryl)-6-hydroxy-5-nitropyrimidin-4(3H)-one. Following Lipinski's Rule of Five, (E)-2-(2-(benzyloxy)-4-(diethylamino)styryl)-6-hydroxy-5-nitropyrimidin-4(3H)-one has 2 hydrogen bond donor(s) and 7 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)-2-(2-(benzyloxy)-4-(diethylamino)styryl)-6-hydroxy-5-nitropyrimidin-4(3H)-one?
The CAS number of (E)-2-(2-(benzyloxy)-4-(diethylamino)styryl)-6-hydroxy-5-nitropyrimidin-4(3H)-one is 708994-87-0.
What is the molecular formula of (E)-2-(2-(benzyloxy)-4-(diethylamino)styryl)-6-hydroxy-5-nitropyrimidin-4(3H)-one?
The molecular formula of (E)-2-(2-(benzyloxy)-4-(diethylamino)styryl)-6-hydroxy-5-nitropyrimidin-4(3H)-one is C23H24N4O5.
What is the molecular weight of (E)-2-(2-(benzyloxy)-4-(diethylamino)styryl)-6-hydroxy-5-nitropyrimidin-4(3H)-one?
The molecular weight of (E)-2-(2-(benzyloxy)-4-(diethylamino)styryl)-6-hydroxy-5-nitropyrimidin-4(3H)-one is 436.17 g/mol.
Where can I buy (E)-2-(2-(benzyloxy)-4-(diethylamino)styryl)-6-hydroxy-5-nitropyrimidin-4(3H)-one?
You can request a quote for (E)-2-(2-(benzyloxy)-4-(diethylamino)styryl)-6-hydroxy-5-nitropyrimidin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-(2-(benzyloxy)-4-(diethylamino)styryl)-6-hydroxy-5-nitropyrimidin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-(2-(benzyloxy)-4-(diethylamino)styryl)-6-hydroxy-5-nitropyrimidin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.