1-{3-[(4-cyclopentyl-4H-1,2,4-triazol-3-yl)methyl]azetidin-1-yl}-2-(2-methylphenyl)ethan-1-one
Chemical Structure Depiction of
1-{3-[(4-cyclopentyl-4H-1,2,4-triazol-3-yl)methyl]azetidin-1-yl}-2-(2-methylphenyl)ethan-1-one
1-{3-[(4-cyclopentyl-4H-1,2,4-triazol-3-yl)methyl]azetidin-1-yl}-2-(2-methylphenyl)ethan-1-one
Compound characteristics
| Compound ID: | S941-0246 |
| Compound Name: | 1-{3-[(4-cyclopentyl-4H-1,2,4-triazol-3-yl)methyl]azetidin-1-yl}-2-(2-methylphenyl)ethan-1-one |
| Molecular Weight: | 338.45 |
| Molecular Formula: | C20 H26 N4 O |
| Smiles: | Cc1ccccc1CC(N1CC(Cc2nncn2C2CCCC2)C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1916 |
| logD: | 3.1915 |
| logSw: | -3.1041 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.276 |
| InChI Key: | RXMATJSSZHLRBZ-UHFFFAOYSA-N |