1-(3,4-dimethyl-2-sulfanylidene-2,3-dihydro-1,3-thiazol-5-yl)ethan-1-one
Chemical Structure Depiction of
1-(3,4-dimethyl-2-sulfanylidene-2,3-dihydro-1,3-thiazol-5-yl)ethan-1-one
1-(3,4-dimethyl-2-sulfanylidene-2,3-dihydro-1,3-thiazol-5-yl)ethan-1-one
Compound characteristics
| Compound ID: | 5504-0225 |
| Compound Name: | 1-(3,4-dimethyl-2-sulfanylidene-2,3-dihydro-1,3-thiazol-5-yl)ethan-1-one |
| Molecular Weight: | 187.28 |
| Molecular Formula: | C7 H9 N O S2 |
| Smiles: | CC1=C(C(C)=O)SC(N1C)=S |
| Stereo: | ACHIRAL |
| logP: | 1.256 |
| logD: | 1.256 |
| logSw: | -1.4781 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 17.023 |
| InChI Key: | PEBZNWZQGFTIPU-UHFFFAOYSA-N |