4-bromo-N-{4-[4-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl}-5-nitro-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
4-bromo-N-{4-[4-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl}-5-nitro-1H-pyrazole-3-carboxamide
4-bromo-N-{4-[4-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl}-5-nitro-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y500-8527 |
| Compound Name: | 4-bromo-N-{4-[4-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl}-5-nitro-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 460.21 |
| Molecular Formula: | C14 H8 Br F2 N5 O4 S |
| Smiles: | c1cc(ccc1c1csc(NC(c2c(c([nH]n2)[N+]([O-])=O)[Br])=O)n1)OC(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.1143 |
| logD: | 4.0189 |
| logSw: | -4.4261 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.556 |
| InChI Key: | GUOWGTRBDGSQKI-UHFFFAOYSA-N |