(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 4-[2-(3,4-dimethylphenoxy)acetamido]benzoate
Chemical Structure Depiction of
(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 4-[2-(3,4-dimethylphenoxy)acetamido]benzoate
(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 4-[2-(3,4-dimethylphenoxy)acetamido]benzoate
Compound characteristics
| Compound ID: | G357-0530 |
| Compound Name: | (2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 4-[2-(3,4-dimethylphenoxy)acetamido]benzoate |
| Molecular Weight: | 492.55 |
| Molecular Formula: | C25 H24 N4 O5 S |
| Smiles: | CCC1=NN2C(=NC(COC(c3ccc(cc3)NC(COc3ccc(C)c(C)c3)=O)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.8023 |
| logD: | 4.7956 |
| logSw: | -4.6602 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.68 |
| InChI Key: | BTKUUTPPLNEJMK-UHFFFAOYSA-N |