2-[(3-benzyl-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-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-5-(piperidin-1-yl)-1,3-oxazole-4-carbonitrile
2-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-5-(piperidin-1-yl)-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | Y070-0770 |
| Compound Name: | 2-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-5-(piperidin-1-yl)-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 410.52 |
| Molecular Formula: | C20 H18 N4 O2 S2 |
| Smiles: | C1CCN(CC1)c1c(C#N)nc(/C=C2/C(N(Cc3ccccc3)C(=S)S2)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.2122 |
| logD: | 4.2122 |
| logSw: | -4.2032 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.896 |
| InChI Key: | NNMFDGHAQJHKNS-UHFFFAOYSA-N |