2-{3-[(2,5-dimethylphenyl)methanesulfonyl]-1H-indol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{3-[(2,5-dimethylphenyl)methanesulfonyl]-1H-indol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one
2-{3-[(2,5-dimethylphenyl)methanesulfonyl]-1H-indol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | E588-0176 |
| Compound Name: | 2-{3-[(2,5-dimethylphenyl)methanesulfonyl]-1H-indol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 410.53 |
| Molecular Formula: | C23 H26 N2 O3 S |
| Smiles: | Cc1ccc(C)c(CS(c2cn(CC(N3CCCC3)=O)c3ccccc23)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.0993 |
| logD: | 4.0993 |
| logSw: | -4.024 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.494 |
| InChI Key: | GYMBPLDIXMVCLH-UHFFFAOYSA-N |