N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)[1,4'-bipiperidine]-1'-carbothioamide
					Chemical Structure Depiction of
N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)[1,4'-bipiperidine]-1'-carbothioamide
			N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)[1,4'-bipiperidine]-1'-carbothioamide
Compound characteristics
| Compound ID: | C066-3554 | 
| Compound Name: | N-(12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-2-yl)[1,4'-bipiperidine]-1'-carbothioamide | 
| Molecular Weight: | 439.62 | 
| Molecular Formula: | C24 H33 N5 O S | 
| Smiles: | C1CCC2=Nc3ccc(cc3C(N2CC1)=O)NC(N1CCC(CC1)N1CCCCC1)=S | 
| Stereo: | ACHIRAL | 
| logP: | 3.495 | 
| logD: | 0.3519 | 
| logSw: | -3.8605 | 
| Hydrogen bond acceptors count: | 6 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 40.711 | 
| InChI Key: | JRLJTCGZGNWSKJ-UHFFFAOYSA-N | 
 
				 
				