3-[(pyridin-3-yl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
3-[(pyridin-3-yl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
3-[(pyridin-3-yl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K284-0400 |
| Compound Name: | 3-[(pyridin-3-yl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 269.32 |
| Molecular Formula: | C14 H11 N3 O S |
| Smiles: | C(c1cccnc1)N1C(c2ccccc2NC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1461 |
| logD: | 2.1458 |
| logSw: | -2.7591 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.836 |
| InChI Key: | PZLVJPPOFNKHFH-UHFFFAOYSA-N |