5-{[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(4-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Chemical Structure Depiction of
5-{[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(4-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
5-{[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(4-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Compound characteristics
| Compound ID: | 3236-0107 |
| Compound Name: | 5-{[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(4-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one |
| Molecular Weight: | 540.44 |
| Molecular Formula: | C27 H18 Br N5 O S |
| Smiles: | Cc1ccc(cc1)c1nc2n(C(/C(=C/c3cn(c4ccccc4)nc3c3ccc(cc3)[Br])S2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.9447 |
| logD: | 6.9447 |
| logSw: | -5.7979 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.829 |
| InChI Key: | LOBFZZIDVKLRIA-UHFFFAOYSA-N |