N-(2H-1,3-benzodioxol-5-yl)-N~2~-[5-(tert-butylamino)-6-(4-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]-N~2~-methylglycinamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-N~2~-[5-(tert-butylamino)-6-(4-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]-N~2~-methylglycinamide
N-(2H-1,3-benzodioxol-5-yl)-N~2~-[5-(tert-butylamino)-6-(4-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]-N~2~-methylglycinamide
Compound characteristics
| Compound ID: | F449-3518 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-N~2~-[5-(tert-butylamino)-6-(4-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]-N~2~-methylglycinamide |
| Molecular Weight: | 492.6 |
| Molecular Formula: | C25 H28 N6 O3 S |
| Smiles: | Cc1ccc(cc1)c1c(NC(C)(C)C)n2c(n1)sc(n2)N(C)CC(Nc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2742 |
| logD: | 5.2739 |
| logSw: | -5.1681 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.547 |
| InChI Key: | RKWGEEVTDSUSSO-UHFFFAOYSA-N |