(E)-2-((3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-nitrobenzylidene)acetohydrazide
TL;DR: (E)-2-((3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-nitrobenzylidene)acetohydrazide (CAS 612828-41-8) is a chemical compound with molecular formula C24H19N5O5S and molecular weight 489.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(4-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(E)-(4-nitrophenyl)methylideneamino]acetamide
Also Known As: (E)-2-((3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-nitrobenzylidene)acetohydrazide, 2-[3-(4-methoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[(4-nitrophenyl)methylideneamino]acetamide, 2-[3-(4-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(E)-(4-nitrophenyl)methylideneamino]acetamide, 2-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(E)-(4-nitrophenyl)methylidene]acetohydrazide, N-[(1E)-2-(4-nitrophenyl)-1-azavinyl]-2-[3-(4-methoxyphenyl)-4-oxo(3-hydroquin azolin-2-ylthio)]acetamide
| Molecular Formula | C24H19N5O5S |
|---|---|
| Molecular Weight | 489.11 g/mol |
| LogP | 3.5449 |
| Topological Polar Surface Area | 128.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 489.1107 |
| Heavy Atoms | 35 |
| Complexity | 1466.9178 |
Chemical Identifiers
| CAS Number | 612828-41-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N/N=C/C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
(E)-2-((3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-nitrobenzylidene)acetohydrazide (CAS 612828-41-8), with molecular formula C24H19N5O5S and molecular weight 489.11 g/mol. IUPAC: 2-[3-(4-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(E)-(4-nitrophenyl)methylideneamino]acetamide.
Chemical Property Profile of (E)-2-((3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-nitrobenzylidene)acetohydrazide
Property Insights of (E)-2-((3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-nitrobenzylidene)acetohydrazide
The XLogP value of 3.5449 indicates that (E)-2-((3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-nitrobenzylidene)acetohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.72 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-((3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-nitrobenzylidene)acetohydrazide. Following Lipinski's Rule of Five, (E)-2-((3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-nitrobenzylidene)acetohydrazide has 1 hydrogen bond donor(s) and 8 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-((3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-nitrobenzylidene)acetohydrazide?
The CAS number of (E)-2-((3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-nitrobenzylidene)acetohydrazide is 612828-41-8.
What is the molecular formula of (E)-2-((3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-nitrobenzylidene)acetohydrazide?
The molecular formula of (E)-2-((3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-nitrobenzylidene)acetohydrazide is C24H19N5O5S.
What is the molecular weight of (E)-2-((3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-nitrobenzylidene)acetohydrazide?
The molecular weight of (E)-2-((3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-nitrobenzylidene)acetohydrazide is 489.11 g/mol.
Where can I buy (E)-2-((3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-nitrobenzylidene)acetohydrazide?
You can request a quote for (E)-2-((3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-nitrobenzylidene)acetohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-((3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-nitrobenzylidene)acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-((3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-nitrobenzylidene)acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.