2-fluoro-N-(3-{[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methoxy}phenyl)benzamide
Chemical Structure Depiction of
2-fluoro-N-(3-{[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methoxy}phenyl)benzamide
2-fluoro-N-(3-{[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methoxy}phenyl)benzamide
Compound characteristics
| Compound ID: | C679-4548 |
| Compound Name: | 2-fluoro-N-(3-{[2-(2-methylpropyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methoxy}phenyl)benzamide |
| Molecular Weight: | 452.51 |
| Molecular Formula: | C23 H21 F N4 O3 S |
| Smiles: | CC(C)CC1=NN2C(=NC(COc3cccc(c3)NC(c3ccccc3F)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.3844 |
| logD: | 4.3788 |
| logSw: | -4.3698 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.765 |
| InChI Key: | HQXSSZZOHHWXDR-UHFFFAOYSA-N |