5-(4-methoxyanilino)-2-{[4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-(4-methoxyanilino)-2-{[4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-1,3-oxazole-4-carbonitrile
5-(4-methoxyanilino)-2-{[4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | Y070-3427 |
| Compound Name: | 5-(4-methoxyanilino)-2-{[4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 462.55 |
| Molecular Formula: | C23 H18 N4 O3 S2 |
| Smiles: | COc1ccc(cc1)Nc1c(C#N)nc(\C=C2/C(N(CCc3ccccc3)C(=S)S2)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.8024 |
| logD: | 4.8024 |
| logSw: | -4.5189 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.619 |
| InChI Key: | VYTZRPPWTBBBEL-UHFFFAOYSA-N |