2-{3-[1-(5-chloro-2-methoxybenzene-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-(5-chloro-2-methoxybenzene-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-(5-chloro-2-methoxybenzene-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: | C614-1080 |
| Compound Name: | 2-{3-[1-(5-chloro-2-methoxybenzene-1-sulfonyl)-1,2,3,6-tetrahydropyridin-4-yl]-2-methyl-1H-indol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 528.07 |
| Molecular Formula: | C27 H30 Cl N3 O4 S |
| Smiles: | Cc1c(C2CCN(CC=2)S(c2cc(ccc2OC)[Cl])(=O)=O)c2ccccc2n1CC(N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5893 |
| logD: | 4.5893 |
| logSw: | -4.9324 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.267 |
| InChI Key: | PUNHFSVXBQKJQR-UHFFFAOYSA-N |