4-methyl-1-{4-oxo-4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl}thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
					Chemical Structure Depiction of
4-methyl-1-{4-oxo-4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl}thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
			4-methyl-1-{4-oxo-4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl}thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | E596-0117 | 
| Compound Name: | 4-methyl-1-{4-oxo-4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl}thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one | 
| Molecular Weight: | 438.51 | 
| Molecular Formula: | C20 H22 N8 O2 S | 
| Smiles: | CN1C(c2c(ccs2)n2c(CCCC(N3CCN(CC3)c3ncccn3)=O)nnc12)=O | 
| Stereo: | ACHIRAL | 
| logP: | 0.9458 | 
| logD: | 0.9458 | 
| logSw: | -1.9086 | 
| Hydrogen bond acceptors count: | 8 | 
| Polar surface area: | 78.777 | 
| InChI Key: | NORIAKIWBYXGJZ-UHFFFAOYSA-N | 
 
				 
				