1-{3-(dimethylamino)-3-[1-(3-methylbutyl)-1H-tetrazol-5-yl]piperidin-1-yl}-2-(2-methylphenyl)ethan-1-one
Chemical Structure Depiction of
1-{3-(dimethylamino)-3-[1-(3-methylbutyl)-1H-tetrazol-5-yl]piperidin-1-yl}-2-(2-methylphenyl)ethan-1-one
1-{3-(dimethylamino)-3-[1-(3-methylbutyl)-1H-tetrazol-5-yl]piperidin-1-yl}-2-(2-methylphenyl)ethan-1-one
Compound characteristics
| Compound ID: | SA20-0705 |
| Compound Name: | 1-{3-(dimethylamino)-3-[1-(3-methylbutyl)-1H-tetrazol-5-yl]piperidin-1-yl}-2-(2-methylphenyl)ethan-1-one |
| Molecular Weight: | 398.55 |
| Molecular Formula: | C22 H34 N6 O |
| Smiles: | CC(C)CCn1c(C2(CCCN(C2)C(Cc2ccccc2C)=O)N(C)C)nnn1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6147 |
| logD: | 3.6063 |
| logSw: | -3.5286 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.904 |
| InChI Key: | JTDNXNCCEFCEBQ-QFIPXVFZSA-N |