2-(2-methyl-3-{1-[4-(2-methylpropyl)benzene-1-sulfonyl]-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-[4-(2-methylpropyl)benzene-1-sulfonyl]-1,2,3,6-tetrahydropyridin-4-yl}-1H-indol-1-yl)-1-(pyrrolidin-1-yl)ethan-1-one
2-(2-methyl-3-{1-[4-(2-methylpropyl)benzene-1-sulfonyl]-1,2,3,6-tetrahydropyridin-4-yl}-1H-indol-1-yl)-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | C614-1085 |
| Compound Name: | 2-(2-methyl-3-{1-[4-(2-methylpropyl)benzene-1-sulfonyl]-1,2,3,6-tetrahydropyridin-4-yl}-1H-indol-1-yl)-1-(pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 519.71 |
| Molecular Formula: | C30 H37 N3 O3 S |
| Smiles: | CC(C)Cc1ccc(cc1)S(N1CCC(=CC1)c1c2ccccc2n(CC(N2CCCC2)=O)c1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9901 |
| logD: | 5.9901 |
| logSw: | -5.6275 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.637 |
| InChI Key: | POSBQGZBPIFIAE-UHFFFAOYSA-N |