3-[(4-chlorophenyl)methyl]-6,7-diethoxy-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
3-[(4-chlorophenyl)methyl]-6,7-diethoxy-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
3-[(4-chlorophenyl)methyl]-6,7-diethoxy-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K284-7326 |
| Compound Name: | 3-[(4-chlorophenyl)methyl]-6,7-diethoxy-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 390.89 |
| Molecular Formula: | C19 H19 Cl N2 O3 S |
| Smiles: | CCOc1cc2C(N(Cc3ccc(cc3)[Cl])C(Nc2cc1OCC)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9256 |
| logD: | 3.9185 |
| logSw: | -4.3913 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.738 |
| InChI Key: | WJDMYSLVPYTZOP-UHFFFAOYSA-N |