2-(4-oxo-3,4-dihydroquinazolin-2-yl)-3-(pyridin-4-yl)prop-2-enenitrile
Chemical Structure Depiction of
2-(4-oxo-3,4-dihydroquinazolin-2-yl)-3-(pyridin-4-yl)prop-2-enenitrile
2-(4-oxo-3,4-dihydroquinazolin-2-yl)-3-(pyridin-4-yl)prop-2-enenitrile
Compound characteristics
| Compound ID: | 3643-1655 |
| Compound Name: | 2-(4-oxo-3,4-dihydroquinazolin-2-yl)-3-(pyridin-4-yl)prop-2-enenitrile |
| Molecular Weight: | 274.28 |
| Molecular Formula: | C16 H10 N4 O |
| Smiles: | C(=C(C#N)/C1NC(c2ccccc2N=1)=O)\c1ccncc1 |
| Stereo: | ACHIRAL |
| logP: | 1.36 |
| logD: | 0.014 |
| logSw: | -1.8082 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.375 |
| InChI Key: | IBKNNPJKKTYJMF-UHFFFAOYSA-N |