2-[2-(4-fluorophenoxy)ethyl]-8-(pyrrolidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Chemical Structure Depiction of
2-[2-(4-fluorophenoxy)ethyl]-8-(pyrrolidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
2-[2-(4-fluorophenoxy)ethyl]-8-(pyrrolidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Compound characteristics
| Compound ID: | M113-0086 |
| Compound Name: | 2-[2-(4-fluorophenoxy)ethyl]-8-(pyrrolidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one |
| Molecular Weight: | 406.43 |
| Molecular Formula: | C18 H19 F N4 O4 S |
| Smiles: | C1CCN(C1)S(C1=CC=CN2C1=NN(CCOc1ccc(cc1)F)C2=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1509 |
| logD: | 2.1509 |
| logSw: | -2.4274 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.774 |
| InChI Key: | DTVAGPYMQGOKHC-UHFFFAOYSA-N |