N-(2-{[(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}phenyl)-2-phenylbutanamide
Chemical Structure Depiction of
N-(2-{[(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}phenyl)-2-phenylbutanamide
N-(2-{[(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}phenyl)-2-phenylbutanamide
Compound characteristics
| Compound ID: | G072-1727 |
| Compound Name: | N-(2-{[(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}phenyl)-2-phenylbutanamide |
| Molecular Weight: | 478.63 |
| Molecular Formula: | C25 H26 N4 O2 S2 |
| Smiles: | CCCC1=NN2C(=NC(CSc3ccccc3NC(C(CC)c3ccccc3)=O)=CC2=O)S1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3879 |
| logD: | 5.3859 |
| logSw: | -5.3778 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.568 |
| InChI Key: | AKZMYOJTSSKXHR-LJQANCHMSA-N |