1-(2,3-dihydro-1H-indol-1-yl)-2-{[4-methyl-6-(pyrrolidine-1-sulfonyl)quinolin-2-yl]sulfanyl}propan-1-one
Chemical Structure Depiction of
1-(2,3-dihydro-1H-indol-1-yl)-2-{[4-methyl-6-(pyrrolidine-1-sulfonyl)quinolin-2-yl]sulfanyl}propan-1-one
1-(2,3-dihydro-1H-indol-1-yl)-2-{[4-methyl-6-(pyrrolidine-1-sulfonyl)quinolin-2-yl]sulfanyl}propan-1-one
Compound characteristics
| Compound ID: | J037-0058 |
| Compound Name: | 1-(2,3-dihydro-1H-indol-1-yl)-2-{[4-methyl-6-(pyrrolidine-1-sulfonyl)quinolin-2-yl]sulfanyl}propan-1-one |
| Molecular Weight: | 481.64 |
| Molecular Formula: | C25 H27 N3 O3 S2 |
| Smiles: | CC(C(N1CCc2ccccc12)=O)Sc1cc(C)c2cc(ccc2n1)S(N1CCCC1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0964 |
| logD: | 5.0964 |
| logSw: | -4.8935 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 55.686 |
| InChI Key: | ZKZPOIZALOJICI-SFHVURJKSA-N |