(E)-N'-(2-chloro-5-nitrobenzylidene)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetohydrazide
TL;DR: (E)-N'-(2-chloro-5-nitrobenzylidene)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetohydrazide (CAS 497823-40-2) is a chemical compound with molecular formula C23H15Cl2N5O4S and molecular weight 527.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-(2-chloro-5-nitrophenyl)methylideneamino]-2-[3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide
Also Known As: (E)-N'-(2-chloro-5-nitrobenzylidene)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetohydrazide, N'-[(E)-(2-chloro-5-nitrophenyl)methylidene]-2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetohydrazide, N-[(1E)-2-(2-chloro-5-nitrophenyl)-1-azavinyl]-2-[3-(4-chlorophenyl)-4-oxo(3-h ydroquinazolin-2-ylthio)]acetamide, N-[(E)-(2-chloro-5-nitrophenyl)methylideneamino]-2-[3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide
| Molecular Formula | C23H15Cl2N5O4S |
|---|---|
| Molecular Weight | 527.02 g/mol |
| LogP | 4.8431 |
| Topological Polar Surface Area | 119.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 527.02216 |
| Heavy Atoms | 35 |
| Complexity | 1523.1284 |
Chemical Identifiers
| CAS Number | 497823-40-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)N/N=C/C3=C(C=CC(=C3)[N+](=O)[O-])Cl)C4=CC=C(C=C4)Cl |
Product Overview
(E)-N'-(2-chloro-5-nitrobenzylidene)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetohydrazide (CAS 497823-40-2), with molecular formula C23H15Cl2N5O4S and molecular weight 527.02 g/mol. IUPAC: N-[(E)-(2-chloro-5-nitrophenyl)methylideneamino]-2-[3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide.
Chemical Property Profile of (E)-N'-(2-chloro-5-nitrobenzylidene)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetohydrazide
Property Insights of (E)-N'-(2-chloro-5-nitrobenzylidene)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetohydrazide
The XLogP value of 4.8431 indicates that (E)-N'-(2-chloro-5-nitrobenzylidene)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.49 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N'-(2-chloro-5-nitrobenzylidene)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetohydrazide. Following Lipinski's Rule of Five, (E)-N'-(2-chloro-5-nitrobenzylidene)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetohydrazide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-N'-(2-chloro-5-nitrobenzylidene)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetohydrazide?
The CAS number of (E)-N'-(2-chloro-5-nitrobenzylidene)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetohydrazide is 497823-40-2.
What is the molecular formula of (E)-N'-(2-chloro-5-nitrobenzylidene)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetohydrazide?
The molecular formula of (E)-N'-(2-chloro-5-nitrobenzylidene)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetohydrazide is C23H15Cl2N5O4S.
What is the molecular weight of (E)-N'-(2-chloro-5-nitrobenzylidene)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetohydrazide?
The molecular weight of (E)-N'-(2-chloro-5-nitrobenzylidene)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetohydrazide is 527.02 g/mol.
Where can I buy (E)-N'-(2-chloro-5-nitrobenzylidene)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetohydrazide?
You can request a quote for (E)-N'-(2-chloro-5-nitrobenzylidene)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N'-(2-chloro-5-nitrobenzylidene)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N'-(2-chloro-5-nitrobenzylidene)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.