N-(2H-1,3-benzodioxol-5-yl)-3-methyl-6-(3-nitrophenyl)imidazo[2,1-b][1,3]thiazole-2-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-3-methyl-6-(3-nitrophenyl)imidazo[2,1-b][1,3]thiazole-2-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-3-methyl-6-(3-nitrophenyl)imidazo[2,1-b][1,3]thiazole-2-carboxamide
Compound characteristics
| Compound ID: | C540-0415 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-3-methyl-6-(3-nitrophenyl)imidazo[2,1-b][1,3]thiazole-2-carboxamide |
| Molecular Weight: | 422.42 |
| Molecular Formula: | C20 H14 N4 O5 S |
| Smiles: | Cc1c(C(Nc2ccc3c(c2)OCO3)=O)sc2nc(cn12)c1cccc(c1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.0898 |
| logD: | 4.0894 |
| logSw: | -4.2093 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.03 |
| InChI Key: | BRKZGJGURXWWJJ-UHFFFAOYSA-N |