3-{[2-(5-{[4-(dimethylamino)phenyl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]amino}-1H-1lambda~6~,2-benzothiazole-1,1-dione
Chemical Structure Depiction of
3-{[2-(5-{[4-(dimethylamino)phenyl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]amino}-1H-1lambda~6~,2-benzothiazole-1,1-dione
3-{[2-(5-{[4-(dimethylamino)phenyl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]amino}-1H-1lambda~6~,2-benzothiazole-1,1-dione
Compound characteristics
| Compound ID: | 8011-4380 |
| Compound Name: | 3-{[2-(5-{[4-(dimethylamino)phenyl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]amino}-1H-1lambda~6~,2-benzothiazole-1,1-dione |
| Molecular Weight: | 456.54 |
| Molecular Formula: | C21 H20 N4 O4 S2 |
| Smiles: | CN(C)c1ccc(/C=C2/C(N(CCNC3c4ccccc4S(N=3)(=O)=O)C(=O)S2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.6223 |
| logD: | 2.6222 |
| logSw: | -3.3741 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.42 |
| InChI Key: | NKRZBFUIJCHANP-UHFFFAOYSA-N |