3-[(3-chlorophenyl)methyl]-6-fluoro-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
3-[(3-chlorophenyl)methyl]-6-fluoro-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
3-[(3-chlorophenyl)methyl]-6-fluoro-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K284-0340 |
| Compound Name: | 3-[(3-chlorophenyl)methyl]-6-fluoro-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 320.77 |
| Molecular Formula: | C15 H10 Cl F N2 O S |
| Smiles: | C(c1cccc(c1)[Cl])N1C(c2cc(ccc2NC1=S)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3025 |
| logD: | 4.2807 |
| logSw: | -4.5769 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.3179 |
| InChI Key: | KAXLDLLEWBDJSL-UHFFFAOYSA-N |