(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 4-[2-(3-methylphenoxy)acetamido]benzoate
Chemical Structure Depiction of
(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 4-[2-(3-methylphenoxy)acetamido]benzoate
(2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 4-[2-(3-methylphenoxy)acetamido]benzoate
Compound characteristics
| Compound ID: | G357-1275 |
| Compound Name: | (2-cyclopropyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 4-[2-(3-methylphenoxy)acetamido]benzoate |
| Molecular Weight: | 490.54 |
| Molecular Formula: | C25 H22 N4 O5 S |
| Smiles: | Cc1cccc(c1)OCC(Nc1ccc(cc1)C(=O)OCC1=CC(N2C(=N1)SC(C1CC1)=N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5064 |
| logD: | 4.4993 |
| logSw: | -4.41 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.029 |
| InChI Key: | YZVYBBDGBIDGEN-UHFFFAOYSA-N |