ethyl 4-(2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazolidin-5-yl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazolidin-5-yl}acetamido)benzoate
ethyl 4-(2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazolidin-5-yl}acetamido)benzoate
Compound characteristics
| Compound ID: | 8016-4258 |
| Compound Name: | ethyl 4-(2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazolidin-5-yl}acetamido)benzoate |
| Molecular Weight: | 549.58 |
| Molecular Formula: | C28 H24 F N3 O6 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CC1C(N(Cc2ccc3c(c2)OCO3)/C(=N/c2ccc(cc2)F)S1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2382 |
| logD: | 5.2378 |
| logSw: | -5.0763 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.883 |
| InChI Key: | GILUMKRTCVOUBA-DEOSSOPVSA-N |