6,7-dimethoxy-3-[(4-methylphenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
6,7-dimethoxy-3-[(4-methylphenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
6,7-dimethoxy-3-[(4-methylphenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K287-0101 |
| Compound Name: | 6,7-dimethoxy-3-[(4-methylphenyl)methyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 342.41 |
| Molecular Formula: | C18 H18 N2 O3 S |
| Smiles: | Cc1ccc(CN2C(c3cc(c(cc3NC2=S)OC)OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.463 |
| logD: | 3.4559 |
| logSw: | -3.6885 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.579 |
| InChI Key: | MXIRTUFAXFVITF-UHFFFAOYSA-N |