N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y502-2701 |
| Compound Name: | N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 355.3 |
| Molecular Formula: | C13 H8 F3 N5 O2 S |
| Smiles: | c1ccc2c(c1)C(N(C(=N2)S)NC(c1cc(C(F)(F)F)n[nH]1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9386 |
| logD: | -4.2598 |
| logSw: | -2.3407 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 74.711 |
| InChI Key: | QVRYTGMNFORZAJ-UHFFFAOYSA-N |