[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-ethylbutanoate
Chemical Structure Depiction of
[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-ethylbutanoate
[5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-ethylbutanoate
Compound characteristics
| Compound ID: | G265-0700 |
| Compound Name: | [5-oxo-2-(thiophen-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-ethylbutanoate |
| Molecular Weight: | 363.46 |
| Molecular Formula: | C16 H17 N3 O3 S2 |
| Smiles: | CCC(CC)C(=O)OCC1=CC(N2C(=N1)SC(c1cccs1)=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5253 |
| logD: | 3.5252 |
| logSw: | -3.5246 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.418 |
| InChI Key: | NBZMPEAVQXASQR-UHFFFAOYSA-N |