4-chloro-1-methyl-N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
4-chloro-1-methyl-N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
4-chloro-1-methyl-N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y502-2704 |
| Compound Name: | 4-chloro-1-methyl-N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 403.77 |
| Molecular Formula: | C14 H9 Cl F3 N5 O2 S |
| Smiles: | Cn1c(C(NN2C(=Nc3ccccc3C2=O)S)=O)c(c(C(F)(F)F)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.0498 |
| logD: | -4.1486 |
| logSw: | -3.1125 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.012 |
| InChI Key: | ZGLOQRSXMASVQT-UHFFFAOYSA-N |