4-(4-methylpiperidine-1-carbonyl)-2-(2-methylpropyl)-3-(thiophen-2-yl)-3,4-dihydroisoquinolin-1(2H)-one
Chemical Structure Depiction of
4-(4-methylpiperidine-1-carbonyl)-2-(2-methylpropyl)-3-(thiophen-2-yl)-3,4-dihydroisoquinolin-1(2H)-one
4-(4-methylpiperidine-1-carbonyl)-2-(2-methylpropyl)-3-(thiophen-2-yl)-3,4-dihydroisoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | E456-0717 |
| Compound Name: | 4-(4-methylpiperidine-1-carbonyl)-2-(2-methylpropyl)-3-(thiophen-2-yl)-3,4-dihydroisoquinolin-1(2H)-one |
| Molecular Weight: | 410.58 |
| Molecular Formula: | C24 H30 N2 O2 S |
| Smiles: | CC(C)CN1C(C(C(N2CCC(C)CC2)=O)c2ccccc2C1=O)c1cccs1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4636 |
| logD: | 4.4636 |
| logSw: | -4.2957 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.589 |
| InChI Key: | HUKMFXZLYHHHSR-UHFFFAOYSA-N |