(E)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide
TL;DR: (E)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide (CAS 497822-92-1) is a chemical compound with molecular formula C25H22ClN5O2S and molecular weight 491.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]acetamide
Also Known As: (E)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide, 2-[3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(E)-(4-dimethylaminophenyl)methylideneamino]acetamide, 2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-{(E)-[4-(dimethylamino)phenyl]methylidene}acetohydrazide, N-{(1E)-2-[4-(dimethylamino)phenyl]-1-azavinyl}-2-[3-(4-chlorophenyl)-4-oxo(3- hydroquinazolin-2-ylthio)]acetamide
| Molecular Formula | C25H22ClN5O2S |
|---|---|
| Molecular Weight | 491.12 g/mol |
| LogP | 4.3475 |
| Topological Polar Surface Area | 79.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 491.1183 |
| Heavy Atoms | 34 |
| Complexity | 1400.0098 |
Chemical Identifiers
| CAS Number | 497822-92-1 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)Cl |
Product Overview
(E)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide (CAS 497822-92-1), with molecular formula C25H22ClN5O2S and molecular weight 491.12 g/mol. IUPAC: 2-[3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]acetamide.
Chemical Property Profile of (E)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide
Property Insights of (E)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide
The XLogP value of 4.3475 indicates that (E)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.59 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide. Following Lipinski's Rule of Five, (E)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide has 1 hydrogen bond donor(s) and 6 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-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide?
The CAS number of (E)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide is 497822-92-1.
What is the molecular formula of (E)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide?
The molecular formula of (E)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide is C25H22ClN5O2S.
What is the molecular weight of (E)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide?
The molecular weight of (E)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide is 491.12 g/mol.
Where can I buy (E)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide?
You can request a quote for (E)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-(dimethylamino)benzylidene)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-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-((3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N'-(4-(dimethylamino)benzylidene)acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.