3-(3-methylphenyl)-2-(4-oxo-3,4-dihydroquinazolin-2-yl)prop-2-enenitrile
Chemical Structure Depiction of
3-(3-methylphenyl)-2-(4-oxo-3,4-dihydroquinazolin-2-yl)prop-2-enenitrile
3-(3-methylphenyl)-2-(4-oxo-3,4-dihydroquinazolin-2-yl)prop-2-enenitrile
Compound characteristics
Compound ID: | 3643-1649 |
Compound Name: | 3-(3-methylphenyl)-2-(4-oxo-3,4-dihydroquinazolin-2-yl)prop-2-enenitrile |
Molecular Weight: | 287.32 |
Molecular Formula: | C18 H13 N3 O |
Smiles: | Cc1cccc(/C=C(C#N)/C2NC(c3ccccc3N=2)=O)c1 |
Stereo: | ACHIRAL |
logP: | 2.9918 |
logD: | 1.6458 |
logSw: | -3.6512 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.947 |
InChI Key: | SFMKBEJYUYQMGN-UHFFFAOYSA-N |