2-{[1-(3-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-[2-(pyrrolidin-1-yl)ethyl]butanamide
Chemical Structure Depiction of
2-{[1-(3-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-[2-(pyrrolidin-1-yl)ethyl]butanamide
2-{[1-(3-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-[2-(pyrrolidin-1-yl)ethyl]butanamide
Compound characteristics
| Compound ID: | V015-6063 |
| Compound Name: | 2-{[1-(3-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-[2-(pyrrolidin-1-yl)ethyl]butanamide |
| Molecular Weight: | 495.64 |
| Molecular Formula: | C29 H38 F N3 O3 |
| Salt: | not_available |
| Smiles: | CCC(C(NCCN1CCCC1)=O)Oc1ccc2CCN(C(c3cccc(c3)F)c2c1)C(C(C)C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8221 |
| logD: | 2.5474 |
| logSw: | -4.4792 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.408 |
| InChI Key: | BEIVGUITTSHCRI-UHFFFAOYSA-N |