2-(2H-1,3-benzodioxol-5-yl)-N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]quinoline-4-carboxamide
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]quinoline-4-carboxamide
2-(2H-1,3-benzodioxol-5-yl)-N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y200-2282 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]quinoline-4-carboxamide |
| Molecular Weight: | 446.53 |
| Molecular Formula: | C24 H22 N4 O3 S |
| Smiles: | CC(C)(C)Cc1nnc(NC(c2cc(c3ccc4c(c3)OCO4)nc3ccccc23)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 6.3153 |
| logD: | 6.2781 |
| logSw: | -5.6633 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.545 |
| InChI Key: | SFNGFIRLWTZQKL-UHFFFAOYSA-N |