2-{4-[4-({3-[(2-chlorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl)benzoyl]piperazin-1-yl}-N-(propan-2-yl)acetamide
Chemical Structure Depiction of
2-{4-[4-({3-[(2-chlorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl)benzoyl]piperazin-1-yl}-N-(propan-2-yl)acetamide
2-{4-[4-({3-[(2-chlorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl)benzoyl]piperazin-1-yl}-N-(propan-2-yl)acetamide
Compound characteristics
| Compound ID: | V022-8741 |
| Compound Name: | 2-{4-[4-({3-[(2-chlorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl)benzoyl]piperazin-1-yl}-N-(propan-2-yl)acetamide |
| Molecular Weight: | 541.07 |
| Molecular Formula: | C27 H29 Cl N4 O4 S |
| Salt: | not_available |
| Smiles: | CC(C)NC(CN1CCN(CC1)C(c1ccc(/C=C2/C(N(Cc3ccccc3[Cl])C(=O)S2)=O)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6952 |
| logD: | 3.6948 |
| logSw: | -4.1449 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.502 |
| InChI Key: | KTUWIOOBSGJMRI-UHFFFAOYSA-N |