N-{5-[4-(ethanesulfonyl)piperazin-1-yl]-2-nitrophenyl}adamantan-2-amine
					Chemical Structure Depiction of
N-{5-[4-(ethanesulfonyl)piperazin-1-yl]-2-nitrophenyl}adamantan-2-amine
			N-{5-[4-(ethanesulfonyl)piperazin-1-yl]-2-nitrophenyl}adamantan-2-amine
Compound characteristics
| Compound ID: | 5820-0788 | 
| Compound Name: | N-{5-[4-(ethanesulfonyl)piperazin-1-yl]-2-nitrophenyl}adamantan-2-amine | 
| Molecular Weight: | 448.58 | 
| Molecular Formula: | C22 H32 N4 O4 S | 
| Smiles: | CCS(N1CCN(CC1)c1ccc(c(c1)NC1C2CC3CC(C2)CC1C3)[N+]([O-])=O)(=O)=O | 
| Stereo: | ACHIRAL | 
| logP: | 4.3205 | 
| logD: | 4.3205 | 
| logSw: | -4.3776 | 
| Hydrogen bond acceptors count: | 9 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 78.34 | 
| InChI Key: | PNXLRXSLRBTQCP-UHFFFAOYSA-N | 
 
				 
				