N-[(4-fluorophenyl)methyl]-6-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-6-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
N-[(4-fluorophenyl)methyl]-6-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
Compound characteristics
| Compound ID: | K284-0906 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-6-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)hexanamide |
| Molecular Weight: | 399.49 |
| Molecular Formula: | C21 H22 F N3 O2 S |
| Smiles: | C(CCC(NCc1ccc(cc1)F)=O)CCN1C(c2ccccc2NC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3878 |
| logD: | 3.3867 |
| logSw: | -3.8261 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.768 |
| InChI Key: | JZXYEBWDFNZPAB-UHFFFAOYSA-N |