(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-phenylbutanoate
Chemical Structure Depiction of
(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-phenylbutanoate
(2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-phenylbutanoate
Compound characteristics
| Compound ID: | G265-0616 |
| Compound Name: | (2-cyclohexyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl 2-phenylbutanoate |
| Molecular Weight: | 411.52 |
| Molecular Formula: | C22 H25 N3 O3 S |
| Smiles: | CCC(C(=O)OCC1=CC(N2C(=N1)SC(C1CCCCC1)=N2)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9793 |
| logD: | 4.9791 |
| logSw: | -4.5575 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.32 |
| InChI Key: | FQBHLPNEJWRCGO-GOSISDBHSA-N |