5-(4-methoxyanilino)-2-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-(4-methoxyanilino)-2-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,3-oxazole-4-carbonitrile
5-(4-methoxyanilino)-2-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | Y070-3431 |
| Compound Name: | 5-(4-methoxyanilino)-2-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 372.42 |
| Molecular Formula: | C16 H12 N4 O3 S2 |
| Smiles: | CN1C(/C(=C\c2nc(C#N)c(Nc3ccc(cc3)OC)o2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7677 |
| logD: | 2.7677 |
| logSw: | -3.5341 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.678 |
| InChI Key: | JPJIQXGUXJTKGK-UHFFFAOYSA-N |