3-(2-fluorophenyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylic acid
Chemical Structure Depiction of
3-(2-fluorophenyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylic acid
3-(2-fluorophenyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylic acid
Compound characteristics
| Compound ID: | A0062798 |
| Compound Name: | 3-(2-fluorophenyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxylic acid |
| Molecular Weight: | 316.31 |
| Molecular Formula: | C15 H9 F N2 O3 S |
| Smiles: | c1ccc(c(c1)N1C(c2ccc(cc2NC1=S)C(O)=O)=O)F |
| Stereo: | ACHIRAL |
| logP: | 2.8613 |
| logD: | -0.2411 |
| logSw: | -3.6255 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.814 |
| InChI Key: | RKNUODKTBUBTHZ-UHFFFAOYSA-N |