4-{5-[(4-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide
Chemical Structure Depiction of
4-{5-[(4-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide
4-{5-[(4-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide
Compound characteristics
| Compound ID: | 4491-2023 |
| Compound Name: | 4-{5-[(4-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanamide |
| Molecular Weight: | 525.51 |
| Molecular Formula: | C20 H21 Br N4 O2 S3 |
| Smiles: | CC(C)Cc1nnc(NC(CCCN2C(/C(=C/c3ccc(cc3)[Br])SC2=S)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.8724 |
| logD: | 4.7867 |
| logSw: | -4.364 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.61 |
| InChI Key: | UWVMGONJNBUIDM-UHFFFAOYSA-N |