ethyl 2-(2-imino-4-oxo-1,3-thiazolidin-3-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(2-imino-4-oxo-1,3-thiazolidin-3-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(2-imino-4-oxo-1,3-thiazolidin-3-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8009-8696 |
| Compound Name: | ethyl 2-(2-imino-4-oxo-1,3-thiazolidin-3-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 324.42 |
| Molecular Formula: | C14 H16 N2 O3 S2 |
| Smiles: | CCOC(c1c2CCCCc2sc1N1C(=N)SCC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5033 |
| logD: | 2.4991 |
| logSw: | -2.3146 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.661 |
| InChI Key: | XHCAOMPCTUADFB-UHFFFAOYSA-N |