2-{3-[1-(3,4-dimethylbenzene-1-sulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-2-methyl-1H-indol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{3-[1-(3,4-dimethylbenzene-1-sulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-2-methyl-1H-indol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one
2-{3-[1-(3,4-dimethylbenzene-1-sulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-2-methyl-1H-indol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | C614-1077 |
| Compound Name: | 2-{3-[1-(3,4-dimethylbenzene-1-sulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-2-methyl-1H-indol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 491.65 |
| Molecular Formula: | C28 H33 N3 O3 S |
| Smiles: | Cc1ccc(cc1C)S(N1CCC(=CC1)c1c2ccccc2n(CC(N2CCCC2)=O)c1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3347 |
| logD: | 5.3347 |
| logSw: | -5.5082 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.637 |
| InChI Key: | MFIHBZQGGPYCKE-UHFFFAOYSA-N |