2-{[3-(2-methylpropyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2,3-dihydro-1H-inden-1-one
Chemical Structure Depiction of
2-{[3-(2-methylpropyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2,3-dihydro-1H-inden-1-one
2-{[3-(2-methylpropyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2,3-dihydro-1H-inden-1-one
Compound characteristics
| Compound ID: | C151-0466 |
| Compound Name: | 2-{[3-(2-methylpropyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2,3-dihydro-1H-inden-1-one |
| Molecular Weight: | 342.44 |
| Molecular Formula: | C23 H22 N2 O |
| Smiles: | CC(C)Cc1c(\C=C2/Cc3ccccc3C2=O)cn(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.4272 |
| logD: | 5.4272 |
| logSw: | -5.4082 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 28.7993 |
| InChI Key: | JDJSUDPLHNWLPM-UHFFFAOYSA-N |