2-[(3-fluorophenyl)methyl]-8-[4-(4-fluorophenyl)piperazine-1-sulfonyl][1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Chemical Structure Depiction of
2-[(3-fluorophenyl)methyl]-8-[4-(4-fluorophenyl)piperazine-1-sulfonyl][1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
2-[(3-fluorophenyl)methyl]-8-[4-(4-fluorophenyl)piperazine-1-sulfonyl][1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Compound characteristics
| Compound ID: | M113-1646 |
| Compound Name: | 2-[(3-fluorophenyl)methyl]-8-[4-(4-fluorophenyl)piperazine-1-sulfonyl][1,2,4]triazolo[4,3-a]pyridin-3(2H)-one |
| Molecular Weight: | 485.51 |
| Molecular Formula: | C23 H21 F2 N5 O3 S |
| Smiles: | C1CN(CCN1c1ccc(cc1)F)S(C1=CC=CN2C1=NN(Cc1cccc(c1)F)C2=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.241 |
| logD: | 3.241 |
| logSw: | -3.3825 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.273 |
| InChI Key: | YRBZYNQYDGBDAI-UHFFFAOYSA-N |