N-{[4-(methylsulfanyl)phenyl]methyl}-3-[5-(pyrrolidine-1-sulfonyl)-1H-indol-1-yl]propanamide
Chemical Structure Depiction of
N-{[4-(methylsulfanyl)phenyl]methyl}-3-[5-(pyrrolidine-1-sulfonyl)-1H-indol-1-yl]propanamide
N-{[4-(methylsulfanyl)phenyl]methyl}-3-[5-(pyrrolidine-1-sulfonyl)-1H-indol-1-yl]propanamide
Compound characteristics
| Compound ID: | E848-2010 |
| Compound Name: | N-{[4-(methylsulfanyl)phenyl]methyl}-3-[5-(pyrrolidine-1-sulfonyl)-1H-indol-1-yl]propanamide |
| Molecular Weight: | 457.61 |
| Molecular Formula: | C23 H27 N3 O3 S2 |
| Smiles: | CSc1ccc(CNC(CCn2ccc3cc(ccc23)S(N2CCCC2)(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8543 |
| logD: | 3.8543 |
| logSw: | -3.8482 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.604 |
| InChI Key: | KAVYYDDKVUDNRK-UHFFFAOYSA-N |