N-(5-methyl-1,3,4-thiadiazol-2-yl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-(5-methyl-1,3,4-thiadiazol-2-yl)-2H-1,3-benzodioxole-5-carboxamide
N-(5-methyl-1,3,4-thiadiazol-2-yl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | Y030-5430 |
| Compound Name: | N-(5-methyl-1,3,4-thiadiazol-2-yl)-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 263.27 |
| Molecular Formula: | C11 H9 N3 O3 S |
| Smiles: | Cc1nnc(NC(c2ccc3c(c2)OCO3)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 1.8701 |
| logD: | 1.6724 |
| logSw: | -2.6563 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.796 |
| InChI Key: | PCRVABPCZOGPGA-UHFFFAOYSA-N |