3-[(4-methylphenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
3-[(4-methylphenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
3-[(4-methylphenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K287-0228 |
| Compound Name: | 3-[(4-methylphenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 282.36 |
| Molecular Formula: | C16 H14 N2 O S |
| Smiles: | Cc1ccc(CN2C(c3ccccc3NC2=S)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8826 |
| logD: | 3.8822 |
| logSw: | -3.9625 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.3179 |
| InChI Key: | PAOXDBRSTNPEPR-UHFFFAOYSA-N |