3-(4-fluorophenyl)-4-oxo-N-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-(4-fluorophenyl)-4-oxo-N-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
3-(4-fluorophenyl)-4-oxo-N-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0061774 |
| Compound Name: | 3-(4-fluorophenyl)-4-oxo-N-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 399.44 |
| Molecular Formula: | C20 H18 F N3 O3 S |
| Smiles: | C1CC(CNC(c2ccc3C(N(C(Nc3c2)=S)c2ccc(cc2)F)=O)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0643 |
| logD: | 2.0507 |
| logSw: | -3.056 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.774 |
| InChI Key: | DDNSALLCZCNALO-OAHLLOKOSA-N |