2-{[4-(methylsulfanyl)phenyl]methylidene}-2,3-dihydro-1H-inden-1-one
Chemical Structure Depiction of
2-{[4-(methylsulfanyl)phenyl]methylidene}-2,3-dihydro-1H-inden-1-one
2-{[4-(methylsulfanyl)phenyl]methylidene}-2,3-dihydro-1H-inden-1-one
Compound characteristics
| Compound ID: | C151-0216 |
| Compound Name: | 2-{[4-(methylsulfanyl)phenyl]methylidene}-2,3-dihydro-1H-inden-1-one |
| Molecular Weight: | 266.36 |
| Molecular Formula: | C17 H14 O S |
| Smiles: | CSc1ccc(\C=C2/Cc3ccccc3C2=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.641 |
| logD: | 4.641 |
| logSw: | -4.6633 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 13.3999 |
| InChI Key: | PXPPCDWTJHAURJ-UHFFFAOYSA-N |