[2-(2-ethoxyethyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl (phenylsulfanyl)acetate
Chemical Structure Depiction of
[2-(2-ethoxyethyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl (phenylsulfanyl)acetate
[2-(2-ethoxyethyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl (phenylsulfanyl)acetate
Compound characteristics
| Compound ID: | G265-1024 |
| Compound Name: | [2-(2-ethoxyethyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl (phenylsulfanyl)acetate |
| Molecular Weight: | 405.49 |
| Molecular Formula: | C18 H19 N3 O4 S2 |
| Smiles: | CCOCCC1=NN2C(=NC(COC(CSc3ccccc3)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 2.739 |
| logD: | 2.7383 |
| logSw: | -3.0077 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 66.686 |
| InChI Key: | XTCQWUBUDKROQV-UHFFFAOYSA-N |