2-(4-{4-[(3-benzyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]benzoyl}piperazin-1-yl)benzonitrile
Chemical Structure Depiction of
2-(4-{4-[(3-benzyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]benzoyl}piperazin-1-yl)benzonitrile
2-(4-{4-[(3-benzyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]benzoyl}piperazin-1-yl)benzonitrile
Compound characteristics
| Compound ID: | V019-7170 |
| Compound Name: | 2-(4-{4-[(3-benzyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]benzoyl}piperazin-1-yl)benzonitrile |
| Molecular Weight: | 508.6 |
| Molecular Formula: | C29 H24 N4 O3 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN1C(c1ccc(/C=C2/C(N(Cc3ccccc3)C(=O)S2)=O)cc1)=O)c1ccccc1C#N |
| Stereo: | ACHIRAL |
| logP: | 4.5717 |
| logD: | 4.5717 |
| logSw: | -4.5266 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.259 |
| InChI Key: | DDMSEDXOPNORAI-UHFFFAOYSA-N |