1-(2-(delta-2-Imidazolinyl)thio)-2-(2-benzoyl-4-chloro)anilinoethane
TL;DR: 1-(2-(delta-2-Imidazolinyl)thio)-2-(2-benzoyl-4-chloro)anilinoethane (CAS 128433-29-4) is a chemical compound with molecular formula C18H18ClN3OS and molecular weight 359.0859 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[5-chloro-2-[2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)ethylamino]phenyl]-phenylmethanone
Also Known As: 1-(2-(delta-2-Imidazolinyl)thio)-2-(2-benzoyl-4-chloro)anilinoethane, Methanone, (5-chloro-2-((2-((4,5-dihydro-1H-imidazol-2-yl)thio)ethyl)amino)phenyl)phenyl-, (5-Chloro-2-((2-((4,5-dihydro-1H-imidazol-2-yl)thio)ethyl)amino)phenyl)phenylmethanone, [5-chloro-2-[2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)ethylamino]phenyl]-phenylmethanone, [5-Chloro-2-({2-[(4,5-dihydro-1H-imidazol-2-yl)sulfanyl]ethyl}amino)phenyl](phenyl)methanone
Technical Specifications
| Molecular Formula | C18H18ClN3OS |
| Molecular Weight | 359.0859 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 78.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 359.0859 Da |
| Heavy Atoms | 24 |
| Complexity | 454.0 |
| SMILES | C1CN=C(N1)SCCNC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3 |
| InChIKey | CDEXPVJGPNJCGH-UHFFFAOYSA-N |
Chemical Property Profile of 1-(2-(delta-2-Imidazolinyl)thio)-2-(2-benzoyl-4-chloro)anilinoethane
Property Insights of 1-(2-(delta-2-Imidazolinyl)thio)-2-(2-benzoyl-4-chloro)anilinoethane
The XLogP value of 4.4 indicates that 1-(2-(delta-2-Imidazolinyl)thio)-2-(2-benzoyl-4-chloro)anilinoethane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-(delta-2-Imidazolinyl)thio)-2-(2-benzoyl-4-chloro)anilinoethane. Following Lipinski's Rule of Five, 1-(2-(delta-2-Imidazolinyl)thio)-2-(2-benzoyl-4-chloro)anilinoethane has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(2-(delta-2-Imidazolinyl)thio)-2-(2-benzoyl-4-chloro)anilinoethane?
The CAS number of 1-(2-(delta-2-Imidazolinyl)thio)-2-(2-benzoyl-4-chloro)anilinoethane is 128433-29-4.
What is the molecular formula of 1-(2-(delta-2-Imidazolinyl)thio)-2-(2-benzoyl-4-chloro)anilinoethane?
The molecular formula of 1-(2-(delta-2-Imidazolinyl)thio)-2-(2-benzoyl-4-chloro)anilinoethane is C18H18ClN3OS.
What is the molecular weight of 1-(2-(delta-2-Imidazolinyl)thio)-2-(2-benzoyl-4-chloro)anilinoethane?
The molecular weight of 1-(2-(delta-2-Imidazolinyl)thio)-2-(2-benzoyl-4-chloro)anilinoethane is 359.0859 g/mol.
Where can I buy 1-(2-(delta-2-Imidazolinyl)thio)-2-(2-benzoyl-4-chloro)anilinoethane?
You can request a quote for 1-(2-(delta-2-Imidazolinyl)thio)-2-(2-benzoyl-4-chloro)anilinoethane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(2-(delta-2-Imidazolinyl)thio)-2-(2-benzoyl-4-chloro)anilinoethane?
Yes, CoreyChem provides custom synthesis services for 1-(2-(delta-2-Imidazolinyl)thio)-2-(2-benzoyl-4-chloro)anilinoethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.