2-{[3-(2-methoxyethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-5-(piperidin-1-yl)-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
2-{[3-(2-methoxyethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-5-(piperidin-1-yl)-1,3-oxazole-4-carbonitrile
2-{[3-(2-methoxyethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-5-(piperidin-1-yl)-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | Y070-4219 |
| Compound Name: | 2-{[3-(2-methoxyethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-5-(piperidin-1-yl)-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 378.47 |
| Molecular Formula: | C16 H18 N4 O3 S2 |
| Smiles: | COCCN1C(/C(=C\c2nc(C#N)c(N3CCCCC3)o2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4311 |
| logD: | 2.4311 |
| logSw: | -2.3843 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.488 |
| InChI Key: | FCTJPTBNTUNSOR-UHFFFAOYSA-N |