3,4,5-triethoxy-N-[(5-oxo-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]benzamide
Chemical Structure Depiction of
3,4,5-triethoxy-N-[(5-oxo-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]benzamide
3,4,5-triethoxy-N-[(5-oxo-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]benzamide
Compound characteristics
| Compound ID: | F527-0078 |
| Compound Name: | 3,4,5-triethoxy-N-[(5-oxo-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]benzamide |
| Molecular Weight: | 494.57 |
| Molecular Formula: | C25 H26 N4 O5 S |
| Smiles: | CCOc1cc(cc(c1OCC)OCC)C(NCC1=CC(N2C(=N1)SC(c1ccccc1)=N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4346 |
| logD: | 3.4337 |
| logSw: | -3.7367 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.401 |
| InChI Key: | LRXGDOYYPFBWIS-UHFFFAOYSA-N |