![N-(4-chlorophenyl)-2-((5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)thio)acetamide structure](/static/products/587/587014-01-5.png)
N-(4-chlorophenyl)-2-((5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)thio)acetamide
TL;DR: N-(4-chlorophenyl)-2-((5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)thio)acetamide (CAS 587014-01-5) is a chemical compound with molecular formula C24H24ClN3O2S and molecular weight 453.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-2-[(5-ethyl-3,5-dimethyl-4-oxo-6H-benzo[h]quinazolin-2-yl)sulfanyl]acetamide
Also Known As: N-(4-chlorophenyl)-2-((5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)thio)acetamide, N-(4-chlorophenyl)-2-[(5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)sulfanyl]acetamide, N-(4-chlorophenyl)-2-[(5-ethyl-3,5-dimethyl-4-oxo-6H-benzo[h]quinazolin-2-yl)sulfanyl]acetamide
| Molecular Formula | C24H24ClN3O2S |
|---|---|
| Molecular Weight | 453.13 g/mol |
| LogP | 5.0553 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 453.12778 |
| Heavy Atoms | 31 |
| Complexity | 1206.4365 |
Chemical Identifiers
| CAS Number | 587014-01-5 |
|---|---|
| SMILES | CCC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=N3)SCC(=O)NC4=CC=C(C=C4)Cl)C)C |
Product Overview
N-(4-chlorophenyl)-2-((5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)thio)acetamide (CAS 587014-01-5), with molecular formula C24H24ClN3O2S and molecular weight 453.13 g/mol. IUPAC: N-(4-chlorophenyl)-2-[(5-ethyl-3,5-dimethyl-4-oxo-6H-benzo[h]quinazolin-2-yl)sulfanyl]acetamide.
Chemical Property Profile of N-(4-chlorophenyl)-2-((5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)thio)acetamide
Property Insights of N-(4-chlorophenyl)-2-((5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)thio)acetamide
The XLogP value of 5.0553 indicates that N-(4-chlorophenyl)-2-((5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)thio)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-chlorophenyl)-2-((5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)thio)acetamide. Following Lipinski's Rule of Five, N-(4-chlorophenyl)-2-((5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)thio)acetamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(4-chlorophenyl)-2-((5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)thio)acetamide?
The CAS number of N-(4-chlorophenyl)-2-((5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)thio)acetamide is 587014-01-5.
What is the molecular formula of N-(4-chlorophenyl)-2-((5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)thio)acetamide?
The molecular formula of N-(4-chlorophenyl)-2-((5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)thio)acetamide is C24H24ClN3O2S.
What is the molecular weight of N-(4-chlorophenyl)-2-((5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)thio)acetamide?
The molecular weight of N-(4-chlorophenyl)-2-((5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)thio)acetamide is 453.13 g/mol.
Where can I buy N-(4-chlorophenyl)-2-((5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)thio)acetamide?
You can request a quote for N-(4-chlorophenyl)-2-((5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)thio)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-chlorophenyl)-2-((5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)thio)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-chlorophenyl)-2-((5-ethyl-3,5-dimethyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)thio)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.