N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-{1-[6-(propylamino)pyrimidin-4-yl]piperidin-4-yl}propanamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-{1-[6-(propylamino)pyrimidin-4-yl]piperidin-4-yl}propanamide
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-{1-[6-(propylamino)pyrimidin-4-yl]piperidin-4-yl}propanamide
Compound characteristics
| Compound ID: | T422-0806 |
| Compound Name: | N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-{1-[6-(propylamino)pyrimidin-4-yl]piperidin-4-yl}propanamide |
| Molecular Weight: | 450.63 |
| Molecular Formula: | C26 H38 N6 O |
| Smiles: | CCCNc1cc(ncn1)N1CCC(CCC(NCCN2CCc3ccccc3C2)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.3568 |
| logD: | 3.9204 |
| logSw: | -4.1443 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.565 |
| InChI Key: | HTUAGSYWRXVJOI-UHFFFAOYSA-N |