6,7-dimethoxy-3-[(pyridin-2-yl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
6,7-dimethoxy-3-[(pyridin-2-yl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
6,7-dimethoxy-3-[(pyridin-2-yl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K287-0093 |
| Compound Name: | 6,7-dimethoxy-3-[(pyridin-2-yl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 329.38 |
| Molecular Formula: | C16 H15 N3 O3 S |
| Smiles: | COc1cc2C(N(Cc3ccccn3)C(Nc2cc1OC)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7533 |
| logD: | 1.7433 |
| logSw: | -2.7825 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.122 |
| InChI Key: | NJQSBMCSKKBVHK-UHFFFAOYSA-N |