N-(4-fluorophenyl)-3-[(5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)amino]benzamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-3-[(5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)amino]benzamide
N-(4-fluorophenyl)-3-[(5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)amino]benzamide
Compound characteristics
| Compound ID: | F127-0561 |
| Compound Name: | N-(4-fluorophenyl)-3-[(5-oxo-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)amino]benzamide |
| Molecular Weight: | 431.45 |
| Molecular Formula: | C22 H14 F N5 O2 S |
| Smiles: | c1ccc2c(c1)C(N1C(=N2)SC(Nc2cccc(c2)C(Nc2ccc(cc2)F)=O)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0356 |
| logD: | 3.9992 |
| logSw: | -4.322 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.958 |
| InChI Key: | MBQQKLKRQJAAPC-UHFFFAOYSA-N |