2-(3,4-dimethylphenyl)-5-methyl-4-[(propylamino)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(3,4-dimethylphenyl)-5-methyl-4-[(propylamino)methylidene]-2,4-dihydro-3H-pyrazol-3-one
2-(3,4-dimethylphenyl)-5-methyl-4-[(propylamino)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8005-3139 |
| Compound Name: | 2-(3,4-dimethylphenyl)-5-methyl-4-[(propylamino)methylidene]-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 271.36 |
| Molecular Formula: | C16 H21 N3 O |
| Smiles: | CCCN/C=C1\C(C)=NN(C1=O)c1ccc(C)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.0343 |
| logD: | 2.9923 |
| logSw: | -3.1025 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.832 |
| InChI Key: | LXZSANICQOHKLF-UHFFFAOYSA-N |