4-{[2-(3-fluorophenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-N-(4-methoxyphenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-{[2-(3-fluorophenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-N-(4-methoxyphenyl)piperazine-1-carboxamide
4-{[2-(3-fluorophenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-N-(4-methoxyphenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | G768-1414 |
| Compound Name: | 4-{[2-(3-fluorophenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-N-(4-methoxyphenyl)piperazine-1-carboxamide |
| Molecular Weight: | 494.55 |
| Molecular Formula: | C24 H23 F N6 O3 S |
| Smiles: | COc1ccc(cc1)NC(N1CCN(CC1)CC1=CC(N2C(=N1)SC(c1cccc(c1)F)=N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7501 |
| logD: | 2.6656 |
| logSw: | -3.4907 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.824 |
| InChI Key: | HVRLNRXYZGHYTN-UHFFFAOYSA-N |