2-methyl-1-oxo-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-methyl-1-oxo-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-1,2-dihydroisoquinoline-4-carboxamide
2-methyl-1-oxo-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y042-5042 |
| Compound Name: | 2-methyl-1-oxo-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 328.39 |
| Molecular Formula: | C16 H16 N4 O2 S |
| Smiles: | CC(C)c1nnc(NC(C2=CN(C)C(c3ccccc23)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.0434 |
| logD: | 0.0161 |
| logSw: | -2.8849 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.823 |
| InChI Key: | KSGDDJCLXYSETH-UHFFFAOYSA-N |