2-({3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-5-(morpholin-4-yl)-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
2-({3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-5-(morpholin-4-yl)-1,3-oxazole-4-carbonitrile
2-({3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-5-(morpholin-4-yl)-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | Y070-3568 |
| Compound Name: | 2-({3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-5-(morpholin-4-yl)-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 486.57 |
| Molecular Formula: | C22 H22 N4 O5 S2 |
| Smiles: | COc1ccc(CCN2C(/C(=C\c3nc(C#N)c(N4CCOCC4)o3)SC2=S)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.6697 |
| logD: | 2.6697 |
| logSw: | -2.9436 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 79.044 |
| InChI Key: | POHSGVDSGIYBON-UHFFFAOYSA-N |