2-(3-chlorophenyl)-1-{3-(dimethylamino)-3-[1-(3-methylbutyl)-1H-tetrazol-5-yl]piperidin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(3-chlorophenyl)-1-{3-(dimethylamino)-3-[1-(3-methylbutyl)-1H-tetrazol-5-yl]piperidin-1-yl}ethan-1-one
2-(3-chlorophenyl)-1-{3-(dimethylamino)-3-[1-(3-methylbutyl)-1H-tetrazol-5-yl]piperidin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | SA20-0670 |
| Compound Name: | 2-(3-chlorophenyl)-1-{3-(dimethylamino)-3-[1-(3-methylbutyl)-1H-tetrazol-5-yl]piperidin-1-yl}ethan-1-one |
| Molecular Weight: | 418.97 |
| Molecular Formula: | C21 H31 Cl N6 O |
| Smiles: | CC(C)CCn1c(C2(CCCN(C2)C(Cc2cccc(c2)[Cl])=O)N(C)C)nnn1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5588 |
| logD: | 3.5504 |
| logSw: | -3.7449 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.904 |
| InChI Key: | YWDDZBFQALWKFY-NRFANRHFSA-N |