N-[(2-ethyl-6-methylimidazo[2,1-b][1,3,4]thiadiazol-5-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[(2-ethyl-6-methylimidazo[2,1-b][1,3,4]thiadiazol-5-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide
N-[(2-ethyl-6-methylimidazo[2,1-b][1,3,4]thiadiazol-5-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | P169-0285 |
| Compound Name: | N-[(2-ethyl-6-methylimidazo[2,1-b][1,3,4]thiadiazol-5-yl)methyl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 344.39 |
| Molecular Formula: | C16 H16 N4 O3 S |
| Smiles: | CCc1nn2c(CNC(c3ccc4c(c3)OCO4)=O)c(C)nc2s1 |
| Stereo: | ACHIRAL |
| logP: | 2.4836 |
| logD: | 2.4836 |
| logSw: | -2.9438 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.123 |
| InChI Key: | ICVPOAHSGZEYBA-UHFFFAOYSA-N |