2-(diethylamino)ethyl 4-(4-{5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}butanamido)benzoate
Chemical Structure Depiction of
2-(diethylamino)ethyl 4-(4-{5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}butanamido)benzoate
2-(diethylamino)ethyl 4-(4-{5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}butanamido)benzoate
Compound characteristics
| Compound ID: | 1503-1379 |
| Compound Name: | 2-(diethylamino)ethyl 4-(4-{5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}butanamido)benzoate |
| Molecular Weight: | 555.72 |
| Molecular Formula: | C28 H33 N3 O5 S2 |
| Smiles: | CCN(CC)CCOC(c1ccc(cc1)NC(CCCN1C(/C(=C/c2ccc(cc2)OC)SC1=S)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5008 |
| logD: | 3.5324 |
| logSw: | -4.0343 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.573 |
| InChI Key: | DMRDVPLWZYLNAN-UHFFFAOYSA-N |