5-[(4-bromophenyl)methylidene]-2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-1,3-thiazol-4(5H)-one
Chemical Structure Depiction of
5-[(4-bromophenyl)methylidene]-2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-1,3-thiazol-4(5H)-one
5-[(4-bromophenyl)methylidene]-2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-1,3-thiazol-4(5H)-one
Compound characteristics
| Compound ID: | 5499-0683 |
| Compound Name: | 5-[(4-bromophenyl)methylidene]-2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]-1,3-thiazol-4(5H)-one |
| Molecular Weight: | 469.36 |
| Molecular Formula: | C21 H17 Br N4 O2 S |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)NC1=NC(/C(=C/c2ccc(cc2)[Br])S1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1707 |
| logD: | 2.2971 |
| logSw: | -3.4312 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.006 |
| InChI Key: | PLXXXILDRZWHQL-UHFFFAOYSA-N |