(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl thiophene-2-carboxylate
Chemical Structure Depiction of
(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl thiophene-2-carboxylate
(2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | G265-0129 |
| Compound Name: | (2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl thiophene-2-carboxylate |
| Molecular Weight: | 321.37 |
| Molecular Formula: | C13 H11 N3 O3 S2 |
| Smiles: | CCC1=NN2C(=NC(COC(c3cccs3)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 2.4636 |
| logD: | 2.4571 |
| logSw: | -2.5016 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.322 |
| InChI Key: | UMQFSNSYNLAKFJ-UHFFFAOYSA-N |