(5-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetic acid
Chemical Structure Depiction of
(5-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetic acid
(5-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetic acid
Compound characteristics
| Compound ID: | 3229-2086 |
| Compound Name: | (5-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetic acid |
| Molecular Weight: | 401.3 |
| Molecular Formula: | C14 H13 Br N2 O3 S2 |
| Smiles: | CN(C)c1ccc(\C=C2/C(N(CC(O)=O)C(=S)S2)=O)cc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 1.9434 |
| logD: | -1.1755 |
| logSw: | -2.5998 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.602 |
| InChI Key: | BVZYEVLCTAOWRA-UHFFFAOYSA-N |