3-(4-{[4-(dipropylamino)phenyl]methylidene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid
Chemical Structure Depiction of
3-(4-{[4-(dipropylamino)phenyl]methylidene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid
3-(4-{[4-(dipropylamino)phenyl]methylidene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid
Compound characteristics
| Compound ID: | 3697-0149 |
| Compound Name: | 3-(4-{[4-(dipropylamino)phenyl]methylidene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid |
| Molecular Weight: | 405.5 |
| Molecular Formula: | C24 H27 N3 O3 |
| Smiles: | CCCN(CCC)c1ccc(/C=C2/C(C)=NN(C2=O)c2cccc(c2)C(O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1858 |
| logD: | 2.2999 |
| logSw: | -4.8929 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.238 |
| InChI Key: | DGBAKXHHIDQNCK-UHFFFAOYSA-N |