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 |