3,5-bis[(2-oxo-2-phenylethyl)sulfanyl]-1,2-thiazole-4-carbonitrile
Chemical Structure Depiction of
3,5-bis[(2-oxo-2-phenylethyl)sulfanyl]-1,2-thiazole-4-carbonitrile
3,5-bis[(2-oxo-2-phenylethyl)sulfanyl]-1,2-thiazole-4-carbonitrile
Compound characteristics
| Compound ID: | 3895-0011 |
| Compound Name: | 3,5-bis[(2-oxo-2-phenylethyl)sulfanyl]-1,2-thiazole-4-carbonitrile |
| Molecular Weight: | 410.53 |
| Molecular Formula: | C20 H14 N2 O2 S3 |
| Smiles: | C(C(c1ccccc1)=O)Sc1c(C#N)c(SCC(c2ccccc2)=O)sn1 |
| Stereo: | ACHIRAL |
| logP: | 4.426 |
| logD: | 4.426 |
| logSw: | -4.5598 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.868 |
| InChI Key: | STATXDQLDONJMI-UHFFFAOYSA-N |