2-{3-[1-(4-bromobenzene-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-(4-bromobenzene-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-(4-bromobenzene-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: | C614-1055 |
| Compound Name: | 2-{3-[1-(4-bromobenzene-1-sulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-2-methyl-1H-indol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 542.49 |
| Molecular Formula: | C26 H28 Br N3 O3 S |
| Smiles: | Cc1c(C2CCN(CC=2)S(c2ccc(cc2)[Br])(=O)=O)c2ccccc2n1CC(N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1436 |
| logD: | 5.1436 |
| logSw: | -5.219 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.637 |
| InChI Key: | NGHAEFORPVUCOZ-UHFFFAOYSA-N |