2-({4-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]phenoxy}methyl)benzonitrile
Chemical Structure Depiction of
2-({4-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]phenoxy}methyl)benzonitrile
2-({4-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]phenoxy}methyl)benzonitrile
Compound characteristics
| Compound ID: | 4281-2209 |
| Compound Name: | 2-({4-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]phenoxy}methyl)benzonitrile |
| Molecular Weight: | 365.39 |
| Molecular Formula: | C24 H15 N O3 |
| Smiles: | C(c1ccccc1C#N)Oc1ccc(C=C2C(c3ccccc3C2=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4339 |
| logD: | 4.4339 |
| logSw: | -4.6545 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.83 |
| InChI Key: | SHWGCWAHUUGCCG-UHFFFAOYSA-N |