N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-1,2,3-thiadiazole-5-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-1,2,3-thiadiazole-5-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-1,2,3-thiadiazole-5-carboxamide
Compound characteristics
| Compound ID: | D319-0824 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-1,2,3-thiadiazole-5-carboxamide |
| Molecular Weight: | 277.3 |
| Molecular Formula: | C12 H11 N3 O3 S |
| Smiles: | Cc1c(C(NCc2ccc3c(c2)OCO3)=O)snn1 |
| Stereo: | ACHIRAL |
| logP: | 1.6097 |
| logD: | 1.6097 |
| logSw: | -2.5072 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.211 |
| InChI Key: | KGXITZFDSWZOAW-UHFFFAOYSA-N |