![1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one structure](/static/products/5662/5662-72-6.webp)
1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one
TL;DR: 1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one (CAS 5662-72-6) is a chemical compound with molecular formula C27H24N4O2S and molecular weight 468.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one
Also Known As: 1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one, 1-{[2-(4-Ethylphenyl)-2-oxoethyl]sulfanyl}-4-[(4-methylphenyl)methyl][1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
| Molecular Formula | C27H24N4O2S |
|---|---|
| Molecular Weight | 468.16 g/mol |
| LogP | 4.93832 |
| Topological Polar Surface Area | 69.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 468.162 |
| Heavy Atoms | 34 |
| Complexity | 1550.7345 |
Chemical Identifiers
| CAS Number | 5662-72-6 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)C(=O)CSC2=NN=C3N2C4=CC=CC=C4C(=O)N3CC5=CC=C(C=C5)C |
Product Overview
1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one (CAS 5662-72-6), with molecular formula C27H24N4O2S and molecular weight 468.16 g/mol. IUPAC: 1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one.
Chemical Property Profile of 1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one
Property Insights of 1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one
The XLogP value of 4.93832 indicates that 1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one. Following Lipinski's Rule of Five, 1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one has 0 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 1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one?
The CAS number of 1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one is 5662-72-6.
What is the molecular formula of 1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one?
The molecular formula of 1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one is C27H24N4O2S.
What is the molecular weight of 1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one?
The molecular weight of 1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one is 468.16 g/mol.
Where can I buy 1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one?
You can request a quote for 1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-4-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]quinazolin-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.