5-(4-methoxyanilino)-2-({4-oxo-3-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-(4-methoxyanilino)-2-({4-oxo-3-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-1,3-oxazole-4-carbonitrile
5-(4-methoxyanilino)-2-({4-oxo-3-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | Y070-3569 |
| Compound Name: | 5-(4-methoxyanilino)-2-({4-oxo-3-[(oxolan-2-yl)methyl]-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 442.51 |
| Molecular Formula: | C20 H18 N4 O4 S2 |
| Smiles: | COc1ccc(cc1)Nc1c(C#N)nc(\C=C2/C(N(CC3CCCO3)C(=S)S2)=O)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1461 |
| logD: | 3.1461 |
| logSw: | -3.5568 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.295 |
| InChI Key: | DXPHGFRWZPLPDG-CQSZACIVSA-N |