2-{2-methyl-3-[1-(phenylmethanesulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-1H-indol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{2-methyl-3-[1-(phenylmethanesulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-1H-indol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one
2-{2-methyl-3-[1-(phenylmethanesulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-1H-indol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | C614-1058 |
| Compound Name: | 2-{2-methyl-3-[1-(phenylmethanesulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-1H-indol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 477.63 |
| Molecular Formula: | C27 H31 N3 O3 S |
| Smiles: | Cc1c(C2CCN(CC=2)S(Cc2ccccc2)(=O)=O)c2ccccc2n1CC(N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9281 |
| logD: | 3.9281 |
| logSw: | -4.1743 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.531 |
| InChI Key: | HORGEVDYNLHIIR-UHFFFAOYSA-N |