6-(butylsulfanyl)-2-methyl-4-oxo-3,4-dihydro-2H-1,3-thiazine-5-carbonitrile
Chemical Structure Depiction of
6-(butylsulfanyl)-2-methyl-4-oxo-3,4-dihydro-2H-1,3-thiazine-5-carbonitrile
6-(butylsulfanyl)-2-methyl-4-oxo-3,4-dihydro-2H-1,3-thiazine-5-carbonitrile
Compound characteristics
| Compound ID: | 7218-1433 |
| Compound Name: | 6-(butylsulfanyl)-2-methyl-4-oxo-3,4-dihydro-2H-1,3-thiazine-5-carbonitrile |
| Molecular Weight: | 242.36 |
| Molecular Formula: | C10 H14 N2 O S2 |
| Smiles: | CCCCSC1=C(C#N)C(NC(C)S1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8996 |
| logD: | 2.8994 |
| logSw: | -3.1377 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.633 |
| InChI Key: | ALTUSADEWMJNGZ-ZETCQYMHSA-N |