2-(4-methylphenoxy)-N-[2-({[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-(4-methylphenoxy)-N-[2-({[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)phenyl]acetamide
2-(4-methylphenoxy)-N-[2-({[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | G072-1100 |
| Compound Name: | 2-(4-methylphenoxy)-N-[2-({[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)phenyl]acetamide |
| Molecular Weight: | 480.61 |
| Molecular Formula: | C24 H24 N4 O3 S2 |
| Smiles: | CC(C)C1=NN2C(=NC(CSc3ccccc3NC(COc3ccc(C)cc3)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.5973 |
| logD: | 4.5932 |
| logSw: | -4.3508 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.95 |
| InChI Key: | KMUUCULQHROKSB-UHFFFAOYSA-N |