2-{[2-benzoyl-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-[4-(prop-2-en-1-yl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-{[2-benzoyl-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-[4-(prop-2-en-1-yl)piperazin-1-yl]ethan-1-one
2-{[2-benzoyl-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-[4-(prop-2-en-1-yl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | V015-2872 |
| Compound Name: | 2-{[2-benzoyl-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-[4-(prop-2-en-1-yl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 509.65 |
| Molecular Formula: | C32 H35 N3 O3 |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)C1c2cc(ccc2CCN1C(c1ccccc1)=O)OCC(N1CCN(CC1)CC=C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.714 |
| logD: | 4.6432 |
| logSw: | -4.5016 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.272 |
| InChI Key: | OXSYKHUTUZVDIQ-HKBQPEDESA-N |