3,5-bis[(2-oxopropyl)sulfanyl]-1,2-thiazole-4-carbonitrile
Chemical Structure Depiction of
3,5-bis[(2-oxopropyl)sulfanyl]-1,2-thiazole-4-carbonitrile
3,5-bis[(2-oxopropyl)sulfanyl]-1,2-thiazole-4-carbonitrile
Compound characteristics
| Compound ID: | 4486-0053 |
| Compound Name: | 3,5-bis[(2-oxopropyl)sulfanyl]-1,2-thiazole-4-carbonitrile |
| Molecular Weight: | 286.39 |
| Molecular Formula: | C10 H10 N2 O2 S3 |
| Smiles: | CC(CSc1c(C#N)c(SCC(C)=O)sn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7414 |
| logD: | 1.7414 |
| logSw: | -1.7744 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.588 |
| InChI Key: | WHNUYUHLQKDZGQ-UHFFFAOYSA-N |