(4-benzylpiperidin-1-yl)[1-(3-chloro-4-methylanilino)isoquinolin-4-yl]methanone
Chemical Structure Depiction of
(4-benzylpiperidin-1-yl)[1-(3-chloro-4-methylanilino)isoquinolin-4-yl]methanone
(4-benzylpiperidin-1-yl)[1-(3-chloro-4-methylanilino)isoquinolin-4-yl]methanone
Compound characteristics
| Compound ID: | C066-1707 |
| Compound Name: | (4-benzylpiperidin-1-yl)[1-(3-chloro-4-methylanilino)isoquinolin-4-yl]methanone |
| Molecular Weight: | 470.01 |
| Molecular Formula: | C29 H28 Cl N3 O |
| Smiles: | Cc1ccc(cc1[Cl])Nc1c2ccccc2c(cn1)C(N1CCC(CC1)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.4298 |
| logD: | 7.4128 |
| logSw: | -6.3563 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.033 |
| InChI Key: | JSGAJYFSCSIYJS-UHFFFAOYSA-N |