(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl 4-[2-(phenylsulfanyl)acetamido]benzoate
Chemical Structure Depiction of
(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl 4-[2-(phenylsulfanyl)acetamido]benzoate
(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl 4-[2-(phenylsulfanyl)acetamido]benzoate
Compound characteristics
Compound ID: | G357-3026 |
Compound Name: | (2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl 4-[2-(phenylsulfanyl)acetamido]benzoate |
Molecular Weight: | 449.48 |
Molecular Formula: | C23 H19 N3 O5 S |
Smiles: | CC1=CC2=NC(COC(c3ccc(cc3)NC(CSc3ccccc3)=O)=O)=CC(N2O1)=O |
Stereo: | ACHIRAL |
logP: | 2.924 |
logD: | 2.9238 |
logSw: | -3.3982 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 82.437 |
InChI Key: | CYAQEZTVUHMUPX-UHFFFAOYSA-N |