6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K287-0111 |
| Compound Name: | 6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 358.41 |
| Molecular Formula: | C18 H18 N2 O4 S |
| Smiles: | COc1ccc(CN2C(c3cc(c(cc3NC2=S)OC)OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0219 |
| logD: | 3.0149 |
| logSw: | -3.4975 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.123 |
| InChI Key: | DFUMSTZRGWEMLS-UHFFFAOYSA-N |