[2-(2-ethoxyethyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-phenylbutanoate
Chemical Structure Depiction of
[2-(2-ethoxyethyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-phenylbutanoate
[2-(2-ethoxyethyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-phenylbutanoate
Compound characteristics
| Compound ID: | G265-1050 |
| Compound Name: | [2-(2-ethoxyethyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl 2-phenylbutanoate |
| Molecular Weight: | 401.48 |
| Molecular Formula: | C20 H23 N3 O4 S |
| Smiles: | CCC(C(=O)OCC1=CC(N2C(=N1)SC(CCOCC)=N2)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4345 |
| logD: | 3.4339 |
| logSw: | -3.6885 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.281 |
| InChI Key: | MBMIQYDADNWRSV-MRXNPFEDSA-N |