2-{4-[3-({3-[(4-fluorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl)benzoyl]piperazin-1-yl}benzonitrile
Chemical Structure Depiction of
2-{4-[3-({3-[(4-fluorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl)benzoyl]piperazin-1-yl}benzonitrile
2-{4-[3-({3-[(4-fluorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl)benzoyl]piperazin-1-yl}benzonitrile
Compound characteristics
| Compound ID: | V019-9096 |
| Compound Name: | 2-{4-[3-({3-[(4-fluorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl)benzoyl]piperazin-1-yl}benzonitrile |
| Molecular Weight: | 526.59 |
| Molecular Formula: | C29 H23 F N4 O3 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN1C(c1cccc(/C=C2/C(N(Cc3ccc(cc3)F)C(=O)S2)=O)c1)=O)c1ccccc1C#N |
| Stereo: | ACHIRAL |
| logP: | 4.6105 |
| logD: | 4.6105 |
| logSw: | -4.4423 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.259 |
| InChI Key: | HNCJTNMMLXCDBZ-UHFFFAOYSA-N |