3-methyl-5-oxo-4-[2-(2,4,6-tribromophenyl)hydrazinylidene]-4,5-dihydro-1H-pyrazole-1-carbothioamide
Chemical Structure Depiction of
3-methyl-5-oxo-4-[2-(2,4,6-tribromophenyl)hydrazinylidene]-4,5-dihydro-1H-pyrazole-1-carbothioamide
3-methyl-5-oxo-4-[2-(2,4,6-tribromophenyl)hydrazinylidene]-4,5-dihydro-1H-pyrazole-1-carbothioamide
Compound characteristics
Compound ID: | 1652-1562 |
Compound Name: | 3-methyl-5-oxo-4-[2-(2,4,6-tribromophenyl)hydrazinylidene]-4,5-dihydro-1H-pyrazole-1-carbothioamide |
Molecular Weight: | 497.99 |
Molecular Formula: | C11 H8 Br3 N5 O S |
Smiles: | CC1\C(C(N(C(N)=S)N=1)=O)=N/Nc1c(cc(cc1[Br])[Br])[Br] |
Stereo: | ACHIRAL |
logP: | 3.228 |
logD: | 3.1577 |
logSw: | -3.4332 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 60.947 |
InChI Key: | UDPCNDGRWRJKOE-UHFFFAOYSA-N |