N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-{4-oxo-2-sulfanylidene-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidin-3-yl}acetamide
Chemical Structure Depiction of
N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-{4-oxo-2-sulfanylidene-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidin-3-yl}acetamide
N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-{4-oxo-2-sulfanylidene-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidin-3-yl}acetamide
Compound characteristics
| Compound ID: | 3324-0961 |
| Compound Name: | N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-{4-oxo-2-sulfanylidene-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidin-3-yl}acetamide |
| Molecular Weight: | 508.64 |
| Molecular Formula: | C21 H24 N4 O5 S3 |
| Smiles: | CC(C)Cc1nnc(NC(CN2C(/C(=C/c3cc(c(c(c3)OC)OC)OC)SC2=S)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.0042 |
| logD: | 3.972 |
| logSw: | -4.1836 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.61 |
| InChI Key: | YZVYBEHWLWWGGY-UHFFFAOYSA-N |