4-([1,4'-bipiperidine]-1'-carbonyl)-2-cyclopentyl-3-(thiophen-2-yl)-3,4-dihydroisoquinolin-1(2H)-one
Chemical Structure Depiction of
4-([1,4'-bipiperidine]-1'-carbonyl)-2-cyclopentyl-3-(thiophen-2-yl)-3,4-dihydroisoquinolin-1(2H)-one
4-([1,4'-bipiperidine]-1'-carbonyl)-2-cyclopentyl-3-(thiophen-2-yl)-3,4-dihydroisoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | E456-1185 |
| Compound Name: | 4-([1,4'-bipiperidine]-1'-carbonyl)-2-cyclopentyl-3-(thiophen-2-yl)-3,4-dihydroisoquinolin-1(2H)-one |
| Molecular Weight: | 491.7 |
| Molecular Formula: | C29 H37 N3 O2 S |
| Smiles: | C1CCN(CC1)C1CCN(CC1)C(C1C(c2cccs2)N(C2CCCC2)C(c2ccccc12)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3692 |
| logD: | 0.8136 |
| logSw: | -4.3018 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.999 |
| InChI Key: | NHGHLROGSGDUJH-UHFFFAOYSA-N |