2-{[2-(cyclopentanecarbonyl)-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-ethyl-N-methylbutanamide
Chemical Structure Depiction of
2-{[2-(cyclopentanecarbonyl)-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-ethyl-N-methylbutanamide
2-{[2-(cyclopentanecarbonyl)-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-ethyl-N-methylbutanamide
Compound characteristics
| Compound ID: | V005-0831 |
| Compound Name: | 2-{[2-(cyclopentanecarbonyl)-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-ethyl-N-methylbutanamide |
| Molecular Weight: | 466.6 |
| Molecular Formula: | C28 H35 F N2 O3 |
| Smiles: | CCC(C(N(C)CC)=O)Oc1ccc2CCN(C(c3ccc(cc3)F)c2c1)C(C1CCCC1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.488 |
| logD: | 5.488 |
| logSw: | -5.2874 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.238 |
| InChI Key: | IFWUPRHSSIOAHV-UHFFFAOYSA-N |