4-[2-(2-chlorophenyl)hydrazinylidene]-5-methyl-2-(phenylmethanesulfonyl)-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-[2-(2-chlorophenyl)hydrazinylidene]-5-methyl-2-(phenylmethanesulfonyl)-2,4-dihydro-3H-pyrazol-3-one
4-[2-(2-chlorophenyl)hydrazinylidene]-5-methyl-2-(phenylmethanesulfonyl)-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
Compound ID: | 8012-3058 |
Compound Name: | 4-[2-(2-chlorophenyl)hydrazinylidene]-5-methyl-2-(phenylmethanesulfonyl)-2,4-dihydro-3H-pyrazol-3-one |
Molecular Weight: | 390.85 |
Molecular Formula: | C17 H15 Cl N4 O3 S |
Smiles: | CC1/C(C(N(N=1)S(Cc1ccccc1)(=O)=O)=O)=N/Nc1ccccc1[Cl] |
Stereo: | ACHIRAL |
logP: | 3.3511 |
logD: | 3.3482 |
logSw: | -3.514 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 73.191 |
InChI Key: | GJUMZMVCPVOWQC-UHFFFAOYSA-N |