1-(2,3-dihydro-1H-indol-1-yl)-2-{[4-methyl-6-(piperidine-1-sulfonyl)quinolin-2-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(2,3-dihydro-1H-indol-1-yl)-2-{[4-methyl-6-(piperidine-1-sulfonyl)quinolin-2-yl]sulfanyl}ethan-1-one
1-(2,3-dihydro-1H-indol-1-yl)-2-{[4-methyl-6-(piperidine-1-sulfonyl)quinolin-2-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | J037-0100 |
| Compound Name: | 1-(2,3-dihydro-1H-indol-1-yl)-2-{[4-methyl-6-(piperidine-1-sulfonyl)quinolin-2-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 481.64 |
| Molecular Formula: | C25 H27 N3 O3 S2 |
| Smiles: | Cc1cc(nc2ccc(cc12)S(N1CCCCC1)(=O)=O)SCC(N1CCc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8611 |
| logD: | 4.8611 |
| logSw: | -4.5481 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 54.793 |
| InChI Key: | FXUJXSALASGSEE-UHFFFAOYSA-N |