N-[2-(cyclohexylsulfanyl)ethyl]-4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]benzamide
Chemical Structure Depiction of
N-[2-(cyclohexylsulfanyl)ethyl]-4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]benzamide
N-[2-(cyclohexylsulfanyl)ethyl]-4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]benzamide
Compound characteristics
| Compound ID: | 5905-2759 |
| Compound Name: | N-[2-(cyclohexylsulfanyl)ethyl]-4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]benzamide |
| Molecular Weight: | 408.61 |
| Molecular Formula: | C25 H32 N2 O S |
| Smiles: | C1CCC(CC1)SCCNC(c1ccc(CN2CCc3ccccc3C2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9333 |
| logD: | 4.6527 |
| logSw: | -4.6127 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.0799 |
| InChI Key: | GPJQMIKRKRCJIH-UHFFFAOYSA-N |