2-{[2-benzoyl-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-[4-(prop-2-en-1-yl)piperazin-1-yl]propan-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]propan-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]propan-1-one
Compound characteristics
| Compound ID: | V015-2903 |
| 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]propan-1-one |
| Molecular Weight: | 523.68 |
| Molecular Formula: | C33 H37 N3 O3 |
| Salt: | not_available |
| Smiles: | CC(C(N1CCN(CC1)CC=C)=O)Oc1ccc2CCN(C(c3cccc(C)c3)c2c1)C(c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3072 |
| logD: | 5.1986 |
| logSw: | -5.3701 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.089 |
| InChI Key: | YKGYULTVIGZECP-UHFFFAOYSA-N |