1-(3,4-dihydroquinolin-1(2H)-yl)-2-({1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1H-indol-3-yl}sulfanyl)ethan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroquinolin-1(2H)-yl)-2-({1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1H-indol-3-yl}sulfanyl)ethan-1-one
1-(3,4-dihydroquinolin-1(2H)-yl)-2-({1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1H-indol-3-yl}sulfanyl)ethan-1-one
Compound characteristics
| Compound ID: | E587-0490 |
| Compound Name: | 1-(3,4-dihydroquinolin-1(2H)-yl)-2-({1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1H-indol-3-yl}sulfanyl)ethan-1-one |
| Molecular Weight: | 461.63 |
| Molecular Formula: | C27 H31 N3 O2 S |
| Smiles: | CC1CCN(CC1)C(Cn1cc(c2ccccc12)SCC(N1CCCc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2984 |
| logD: | 4.2984 |
| logSw: | -4.005 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.148 |
| InChI Key: | VSNNGWXQWROTMU-UHFFFAOYSA-N |