2-{[2-(cyclopropanecarbonyl)-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-[(oxolan-2-yl)methyl]butanamide
Chemical Structure Depiction of
2-{[2-(cyclopropanecarbonyl)-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-[(oxolan-2-yl)methyl]butanamide
2-{[2-(cyclopropanecarbonyl)-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-[(oxolan-2-yl)methyl]butanamide
Compound characteristics
| Compound ID: | V015-9496 |
| Compound Name: | 2-{[2-(cyclopropanecarbonyl)-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-[(oxolan-2-yl)methyl]butanamide |
| Molecular Weight: | 476.62 |
| Molecular Formula: | C29 H36 N2 O4 |
| Smiles: | CCC(C(NCC1CCCO1)=O)Oc1ccc2CCN(C(c3cccc(C)c3)c2c1)C(C1CC1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8841 |
| logD: | 4.8841 |
| logSw: | -4.6018 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.124 |
| InChI Key: | CCDDTBOTZYXRDJ-UHFFFAOYSA-N |