(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3-[(thiophene-2-carbonyl)amino]benzoate
Chemical Structure Depiction of
(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3-[(thiophene-2-carbonyl)amino]benzoate
(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3-[(thiophene-2-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | G357-0587 |
| Compound Name: | (2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 3-[(thiophene-2-carbonyl)amino]benzoate |
| Molecular Weight: | 440.5 |
| Molecular Formula: | C20 H16 N4 O4 S2 |
| Smiles: | CCC1=NN2C(=NC(COC(c3cccc(c3)NC(c3cccs3)=O)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.8248 |
| logD: | 3.8182 |
| logSw: | -4.0052 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.413 |
| InChI Key: | KQUWZSUMQBXNST-UHFFFAOYSA-N |