N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-[5-(piperidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-[5-(piperidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-[5-(piperidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | G015-1227 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-[5-(piperidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 450.61 |
| Molecular Formula: | C24 H30 N6 O S |
| Smiles: | C1CCN(CC1)c1nnc(n2cccc2C(NCCCN2CCc3ccccc3C2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.1828 |
| logD: | 3.033 |
| logSw: | -3.9257 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.773 |
| InChI Key: | GTAKJJFFZLWMDX-UHFFFAOYSA-N |