3-{5-[(4-tert-butylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-[(pyridin-3-yl)methyl]propanamide
Chemical Structure Depiction of
3-{5-[(4-tert-butylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-[(pyridin-3-yl)methyl]propanamide
3-{5-[(4-tert-butylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-[(pyridin-3-yl)methyl]propanamide
Compound characteristics
| Compound ID: | Y070-1374 |
| Compound Name: | 3-{5-[(4-tert-butylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-[(pyridin-3-yl)methyl]propanamide |
| Molecular Weight: | 439.6 |
| Molecular Formula: | C23 H25 N3 O2 S2 |
| Smiles: | CC(C)(C)c1ccc(/C=C2/C(N(CCC(NCc3cccnc3)=O)C(=S)S2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1184 |
| logD: | 4.116 |
| logSw: | -3.907 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.41 |
| InChI Key: | BXCALKMSDBJJML-UHFFFAOYSA-N |