2-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}-8-(pyrrolidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Chemical Structure Depiction of
2-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}-8-(pyrrolidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
2-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}-8-(pyrrolidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Compound characteristics
| Compound ID: | M113-0108 |
| Compound Name: | 2-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}-8-(pyrrolidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one |
| Molecular Weight: | 441.51 |
| Molecular Formula: | C21 H23 N5 O4 S |
| Smiles: | C1CCN(C1)S(C1=CC=CN2C1=NN(Cc1ccc(cc1)N1CCCC1=O)C2=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.703 |
| logD: | 1.703 |
| logSw: | -2.344 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.195 |
| InChI Key: | YBHLKQLEUCALKY-UHFFFAOYSA-N |