3-(2-iodophenyl)-2-(4-oxo-3,4-dihydroquinazolin-2-yl)prop-2-enenitrile
Chemical Structure Depiction of
3-(2-iodophenyl)-2-(4-oxo-3,4-dihydroquinazolin-2-yl)prop-2-enenitrile
3-(2-iodophenyl)-2-(4-oxo-3,4-dihydroquinazolin-2-yl)prop-2-enenitrile
Compound characteristics
Compound ID: | 3643-1615 |
Compound Name: | 3-(2-iodophenyl)-2-(4-oxo-3,4-dihydroquinazolin-2-yl)prop-2-enenitrile |
Molecular Weight: | 399.19 |
Molecular Formula: | C17 H10 I N3 O |
Smiles: | C(=C(C#N)/C1NC(c2ccccc2N=1)=O)\c1ccccc1I |
Stereo: | ACHIRAL |
logP: | 3.0671 |
logD: | 1.6189 |
logSw: | -3.8814 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.947 |
InChI Key: | COUBYWQFURDLBJ-UHFFFAOYSA-N |