2-{4-[3-({3-[(4-fluorophenyl)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-[3-({3-[(4-fluorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl)benzoyl]piperazin-1-yl}-N-(propan-2-yl)acetamide
2-{4-[3-({3-[(4-fluorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl)benzoyl]piperazin-1-yl}-N-(propan-2-yl)acetamide
Compound characteristics
| Compound ID: | V019-9048 |
| Compound Name: | 2-{4-[3-({3-[(4-fluorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl)benzoyl]piperazin-1-yl}-N-(propan-2-yl)acetamide |
| Molecular Weight: | 524.61 |
| Molecular Formula: | C27 H29 F N4 O4 S |
| Salt: | not_available |
| Smiles: | CC(C)NC(CN1CCN(CC1)C(c1cccc(/C=C2/C(N(Cc3ccc(cc3)F)C(=O)S2)=O)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2501 |
| logD: | 3.2498 |
| logSw: | -3.4903 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.502 |
| InChI Key: | SXPBRVUMFQZYOB-UHFFFAOYSA-N |