N-[5-(3-phenoxypropyl)-1,3,4-thiadiazol-2-yl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[5-(3-phenoxypropyl)-1,3,4-thiadiazol-2-yl]-2H-1,3-benzodioxole-5-carboxamide
N-[5-(3-phenoxypropyl)-1,3,4-thiadiazol-2-yl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | Y031-3165 |
| Compound Name: | N-[5-(3-phenoxypropyl)-1,3,4-thiadiazol-2-yl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 383.42 |
| Molecular Formula: | C19 H17 N3 O4 S |
| Smiles: | C(Cc1nnc(NC(c2ccc3c(c2)OCO3)=O)s1)COc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1678 |
| logD: | 3.9775 |
| logSw: | -4.3351 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.632 |
| InChI Key: | FGLUACCIJZQPSF-UHFFFAOYSA-N |