1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one
					Chemical Structure Depiction of
1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one
			1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | D419-0152 | 
| Compound Name: | 1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-{[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one | 
| Molecular Weight: | 437.56 | 
| Molecular Formula: | C23 H27 N5 O2 S | 
| Smiles: | Cc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(N1CCN(CC1)CCO)=O | 
| Stereo: | ACHIRAL | 
| logP: | 2.712 | 
| logD: | 2.6963 | 
| logSw: | -2.7937 | 
| Hydrogen bond acceptors count: | 7 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 61.551 | 
| InChI Key: | NJODDISLVJZTEL-UHFFFAOYSA-N | 
 
				 
				