N-[2-(2-methylpropanamido)-1,3-benzothiazol-5-yl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[2-(2-methylpropanamido)-1,3-benzothiazol-5-yl]-2H-1,3-benzodioxole-5-carboxamide
N-[2-(2-methylpropanamido)-1,3-benzothiazol-5-yl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | F782-1816 |
| Compound Name: | N-[2-(2-methylpropanamido)-1,3-benzothiazol-5-yl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 383.42 |
| Molecular Formula: | C19 H17 N3 O4 S |
| Smiles: | [H]c1cc2c(cc1NC(c1ccc3c(c1)OCO3)=O)nc(NC(C(C)C)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.2379 |
| logD: | 4.2373 |
| logSw: | -4.2916 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.569 |
| InChI Key: | XFYRBCOPYHNXPO-UHFFFAOYSA-N |