1-{1-[4-(4-methylphenyl)piperazine-1-carbonyl]-3,4-dihydroisoquinolin-2(1H)-yl}ethan-1-one
Chemical Structure Depiction of
1-{1-[4-(4-methylphenyl)piperazine-1-carbonyl]-3,4-dihydroisoquinolin-2(1H)-yl}ethan-1-one
1-{1-[4-(4-methylphenyl)piperazine-1-carbonyl]-3,4-dihydroisoquinolin-2(1H)-yl}ethan-1-one
Compound characteristics
| Compound ID: | P368-0175 |
| Compound Name: | 1-{1-[4-(4-methylphenyl)piperazine-1-carbonyl]-3,4-dihydroisoquinolin-2(1H)-yl}ethan-1-one |
| Molecular Weight: | 377.49 |
| Molecular Formula: | C23 H27 N3 O2 |
| Smiles: | [H]c1cccc2C(C(N3CCN(CC3)c3ccc(C)cc3)=O)N(CCc12)C(C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2424 |
| logD: | 3.2417 |
| logSw: | -3.1318 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.781 |
| InChI Key: | PDDVVXHYQFIHRC-JOCHJYFZSA-N |