4-ethyl-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)piperazine-1-carbothioamide
					Chemical Structure Depiction of
4-ethyl-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)piperazine-1-carbothioamide
			4-ethyl-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)piperazine-1-carbothioamide
Compound characteristics
| Compound ID: | C066-3516 | 
| Compound Name: | 4-ethyl-N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)piperazine-1-carbothioamide | 
| Molecular Weight: | 385.53 | 
| Molecular Formula: | C20 H27 N5 O S | 
| Smiles: | CCN1CCN(CC1)C(Nc1ccc2c(c1)C(N1CCCCCC1=N2)=O)=S | 
| Stereo: | ACHIRAL | 
| logP: | 2.3093 | 
| logD: | 1.2387 | 
| logSw: | -3.0889 | 
| Hydrogen bond acceptors count: | 6 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 41.155 | 
| InChI Key: | WXFZJBBAKRXUGL-UHFFFAOYSA-N | 
 
				 
				