(9-oxo-5,7,8,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-4(6H)-yl)acetonitrile
Chemical Structure Depiction of
(9-oxo-5,7,8,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-4(6H)-yl)acetonitrile
(9-oxo-5,7,8,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-4(6H)-yl)acetonitrile
Compound characteristics
| Compound ID: | 8012-2471 |
| Compound Name: | (9-oxo-5,7,8,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-4(6H)-yl)acetonitrile |
| Molecular Weight: | 229.24 |
| Molecular Formula: | C11 H11 N5 O |
| Smiles: | C1CCC2=C(C1)C(n1c(ncn1)N2CC#N)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5075 |
| logD: | 0.5075 |
| logSw: | -0.8335 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 57.538 |
| InChI Key: | QPOWQQUVBORCOC-UHFFFAOYSA-N |