[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 4-[2-(2-methylphenoxy)acetamido]benzoate
Chemical Structure Depiction of
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 4-[2-(2-methylphenoxy)acetamido]benzoate
[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 4-[2-(2-methylphenoxy)acetamido]benzoate
Compound characteristics
Compound ID: | G357-0278 |
Compound Name: | [5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 4-[2-(2-methylphenoxy)acetamido]benzoate |
Molecular Weight: | 492.55 |
Molecular Formula: | C25 H24 N4 O5 S |
Smiles: | CC(C)C1=NN2C(=NC(COC(c3ccc(cc3)NC(COc3ccccc3C)=O)=O)=CC2=O)S1 |
Stereo: | ACHIRAL |
logP: | 4.6949 |
logD: | 4.6864 |
logSw: | -4.566 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 89.864 |
InChI Key: | NSUSEVXVWYJGCF-UHFFFAOYSA-N |