2-(2,5-dimethylphenoxy)-N-{[2-(4-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}acetamide
Chemical Structure Depiction of
2-(2,5-dimethylphenoxy)-N-{[2-(4-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}acetamide
2-(2,5-dimethylphenoxy)-N-{[2-(4-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}acetamide
Compound characteristics
| Compound ID: | F527-0290 |
| Compound Name: | 2-(2,5-dimethylphenoxy)-N-{[2-(4-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}acetamide |
| Molecular Weight: | 434.52 |
| Molecular Formula: | C23 H22 N4 O3 S |
| Smiles: | Cc1ccc(cc1)C1=NN2C(=NC(CNC(COc3cc(C)ccc3C)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.0378 |
| logD: | 4.034 |
| logSw: | -4.1762 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.056 |
| InChI Key: | BTGQTWXTXMOTQX-UHFFFAOYSA-N |