N-(4-chloro-2-fluorophenyl)-4-[2-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)ethyl]piperazine-1-carbothioamide
					Chemical Structure Depiction of
N-(4-chloro-2-fluorophenyl)-4-[2-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)ethyl]piperazine-1-carbothioamide
			N-(4-chloro-2-fluorophenyl)-4-[2-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)ethyl]piperazine-1-carbothioamide
Compound characteristics
| Compound ID: | 3347-3537 | 
| Compound Name: | N-(4-chloro-2-fluorophenyl)-4-[2-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)ethyl]piperazine-1-carbothioamide | 
| Molecular Weight: | 496.99 | 
| Molecular Formula: | C25 H22 Cl F N4 O2 S | 
| Smiles: | C1CN(CCN1CCN1C(c2cccc3cccc(C1=O)c23)=O)C(Nc1ccc(cc1F)[Cl])=S | 
| Stereo: | ACHIRAL | 
| logP: | 4.8456 | 
| logD: | 4.8419 | 
| logSw: | -5.1918 | 
| Hydrogen bond acceptors count: | 7 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 42.823 | 
| InChI Key: | MFOICFZGJJNOPJ-UHFFFAOYSA-N | 
 
				 
				