2-[5-(4-fluorophenyl)-3-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3-thiazole--hydrogen bromide (1/1)
Chemical Structure Depiction of
2-[5-(4-fluorophenyl)-3-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3-thiazole--hydrogen bromide (1/1)
2-[5-(4-fluorophenyl)-3-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3-thiazole--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 3011-0275 |
| Compound Name: | 2-[5-(4-fluorophenyl)-3-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,3-thiazole--hydrogen bromide (1/1) |
| Molecular Weight: | 658.57 |
| Molecular Formula: | C28 H24 F N5 O4 S2 |
| Salt: | HBr |
| Smiles: | C1CCN(C1)S(c1ccc(cc1)c1csc(n1)N1C(CC(c2cccc(c2)[N+]([O-])=O)=N1)c1ccc(cc1)F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.0099 |
| logD: | 7.0099 |
| logSw: | -6.4491 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 88.926 |
| InChI Key: | QYCXUYDCANBQEA-MHZLTWQESA-N |