2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{[2-(4-methoxyphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}acetamide
Chemical Structure Depiction of
2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{[2-(4-methoxyphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}acetamide
2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{[2-(4-methoxyphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}acetamide
Compound characteristics
| Compound ID: | F527-0592 |
| Compound Name: | 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{[2-(4-methoxyphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}acetamide |
| Molecular Weight: | 475.48 |
| Molecular Formula: | C23 H17 N5 O5 S |
| Smiles: | COc1ccc(cc1)C1=NN2C(=NC(CNC(CN3C(c4ccccc4C3=O)=O)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 1.9599 |
| logD: | 1.9592 |
| logSw: | -2.876 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.539 |
| InChI Key: | OFRRFVFKJNXZGT-UHFFFAOYSA-N |