{[3-(4-fluorophenyl)-7-{[(furan-2-yl)methyl]carbamoyl}-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetic acid
Chemical Structure Depiction of
{[3-(4-fluorophenyl)-7-{[(furan-2-yl)methyl]carbamoyl}-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetic acid
{[3-(4-fluorophenyl)-7-{[(furan-2-yl)methyl]carbamoyl}-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetic acid
Compound characteristics
| Compound ID: | K289-0178 |
| Compound Name: | {[3-(4-fluorophenyl)-7-{[(furan-2-yl)methyl]carbamoyl}-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetic acid |
| Molecular Weight: | 453.45 |
| Molecular Formula: | C22 H16 F N3 O5 S |
| Smiles: | C(c1ccco1)NC(c1ccc2C(N(C(=Nc2c1)SCC(O)=O)c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2613 |
| logD: | -0.3193 |
| logSw: | -2.9198 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.977 |
| InChI Key: | FCJOHJGFMPQGEV-UHFFFAOYSA-N |