[3-oxo-6-(pyrrolidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl]acetonitrile
Chemical Structure Depiction of
[3-oxo-6-(pyrrolidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl]acetonitrile
[3-oxo-6-(pyrrolidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl]acetonitrile
Compound characteristics
| Compound ID: | P047-0020 |
| Compound Name: | [3-oxo-6-(pyrrolidine-1-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl]acetonitrile |
| Molecular Weight: | 307.33 |
| Molecular Formula: | C12 H13 N5 O3 S |
| Smiles: | C1CCN(C1)S(C1C=CC2=NN(CC#N)C(N2C=1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.0954 |
| logD: | -0.0955 |
| logSw: | -1.1772 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 82.618 |
| InChI Key: | IRHRUDJNACFXCR-UHFFFAOYSA-N |