N-(3-fluorophenyl)-2-[3-oxo-7-(thiomorpholin-4-yl)[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(3-fluorophenyl)-2-[3-oxo-7-(thiomorpholin-4-yl)[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
N-(3-fluorophenyl)-2-[3-oxo-7-(thiomorpholin-4-yl)[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | P573-7135 |
| Compound Name: | N-(3-fluorophenyl)-2-[3-oxo-7-(thiomorpholin-4-yl)[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 388.42 |
| Molecular Formula: | C17 H17 F N6 O2 S |
| Smiles: | C1CSCCN1C1C=CN2C(N=1)=NN(CC(Nc1cccc(c1)F)=O)C2=O |
| Stereo: | ACHIRAL |
| logP: | 1.4774 |
| logD: | 1.4774 |
| logSw: | -2.4338 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.205 |
| InChI Key: | IZZRYTKDAXPWBT-UHFFFAOYSA-N |