N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-[5-(pyrrolidin-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-(pyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-[5-(pyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | G015-0391 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-[5-(pyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 436.58 |
| Molecular Formula: | C23 H28 N6 O S |
| Smiles: | C1CCN(C1)c1nnc(n2cccc2C(NCCCN2CCc3ccccc3C2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.8795 |
| logD: | 2.7297 |
| logSw: | -3.9011 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.139 |
| InChI Key: | KRDLSLKNZZKRQY-UHFFFAOYSA-N |