(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-[2-(3-methylphenoxy)acetamido]benzoate
Chemical Structure Depiction of
(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-[2-(3-methylphenoxy)acetamido]benzoate
(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-[2-(3-methylphenoxy)acetamido]benzoate
Compound characteristics
Compound ID: | G357-3682 |
Compound Name: | (5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-[2-(3-methylphenoxy)acetamido]benzoate |
Molecular Weight: | 492.55 |
Molecular Formula: | C25 H24 N4 O5 S |
Smiles: | CCCC1=NN2C(=NC(COC(c3ccccc3NC(COc3cccc(C)c3)=O)=O)=CC2=O)S1 |
Stereo: | ACHIRAL |
logP: | 4.4608 |
logD: | 4.4464 |
logSw: | -4.4133 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 88.983 |
InChI Key: | BNOBZBNYDAWSFS-UHFFFAOYSA-N |