N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-{1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl}propanamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-{1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl}propanamide
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-{1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl}propanamide
Compound characteristics
| Compound ID: | T422-0875 |
| Compound Name: | N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-{1-[6-(ethylamino)pyrimidin-4-yl]piperidin-4-yl}propanamide |
| Molecular Weight: | 436.6 |
| Molecular Formula: | C25 H36 N6 O |
| Smiles: | CCNc1cc(ncn1)N1CCC(CCC(NCCN2CCc3ccccc3C2)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.7563 |
| logD: | 3.3199 |
| logSw: | -3.9144 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.349 |
| InChI Key: | OMOWGBIBQKKNSA-UHFFFAOYSA-N |