N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]benzamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]benzamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]benzamide
Compound characteristics
| Compound ID: | D672-0125 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]benzamide |
| Molecular Weight: | 374.53 |
| Molecular Formula: | C25 H30 N2 O |
| Smiles: | C1CCC(CCNC(c2ccc(CN3CCc4ccccc4C3)cc2)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.4126 |
| logD: | 4.132 |
| logSw: | -4.2006 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.0799 |
| InChI Key: | BRSQWAUMOHGRDZ-UHFFFAOYSA-N |