5-benzyl-4-[1-(3,3-dimethylbutyl)piperidin-4-yl]-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
					Chemical Structure Depiction of
5-benzyl-4-[1-(3,3-dimethylbutyl)piperidin-4-yl]-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
			5-benzyl-4-[1-(3,3-dimethylbutyl)piperidin-4-yl]-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | CM4613-6266 | 
| Compound Name: | 5-benzyl-4-[1-(3,3-dimethylbutyl)piperidin-4-yl]-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one | 
| Molecular Weight: | 356.51 | 
| Molecular Formula: | C21 H32 N4 O | 
| Smiles: | CC(C)(C)CCN1CCC(CC1)N1C(Cc2ccccc2)=NN(C)C1=O | 
| Stereo: | ACHIRAL | 
| logP: | 3.959 | 
| logD: | 2.0403 | 
| logSw: | -4.0542 | 
| Hydrogen bond acceptors count: | 4 | 
| Polar surface area: | 34.964 | 
| InChI Key: | MNEYPRDQOLRQRQ-UHFFFAOYSA-N | 
 
				 
				