2-(2-fluorophenyl)-7-{[4-(2-phenylbutanoyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-(2-fluorophenyl)-7-{[4-(2-phenylbutanoyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-(2-fluorophenyl)-7-{[4-(2-phenylbutanoyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-0558 |
| Compound Name: | 2-(2-fluorophenyl)-7-{[4-(2-phenylbutanoyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 491.59 |
| Molecular Formula: | C26 H26 F N5 O2 S |
| Smiles: | CCC(C(N1CCN(CC1)CC1=CC(N2C(=N1)SC(c1ccccc1F)=N2)=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.41 |
| logD: | 3.3987 |
| logSw: | -3.7676 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.459 |
| InChI Key: | QDBPVANCZKDKOS-HXUWFJFHSA-N |