N~2~-(3-chlorophenyl)-N~5~-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1,3,4-thiadiazole-2,5-dicarboxamide
Chemical Structure Depiction of
N~2~-(3-chlorophenyl)-N~5~-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1,3,4-thiadiazole-2,5-dicarboxamide
N~2~-(3-chlorophenyl)-N~5~-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1,3,4-thiadiazole-2,5-dicarboxamide
Compound characteristics
| Compound ID: | G675-1232 |
| Compound Name: | N~2~-(3-chlorophenyl)-N~5~-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1,3,4-thiadiazole-2,5-dicarboxamide |
| Molecular Weight: | 455.96 |
| Molecular Formula: | C22 H22 Cl N5 O2 S |
| Smiles: | C(CNC(c1nnc(C(Nc2cccc(c2)[Cl])=O)s1)=O)CN1CCc2ccccc2C1 |
| Stereo: | ACHIRAL |
| logP: | 3.6871 |
| logD: | 2.5372 |
| logSw: | -4.1708 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.733 |
| InChI Key: | GXQKYUWUZXZDCK-UHFFFAOYSA-N |