6-(hexylsulfanyl)-2-(hydroxymethyl)-4-oxo-3,4-dihydro-2H-1,3-thiazine-5-carbonitrile
Chemical Structure Depiction of
6-(hexylsulfanyl)-2-(hydroxymethyl)-4-oxo-3,4-dihydro-2H-1,3-thiazine-5-carbonitrile
6-(hexylsulfanyl)-2-(hydroxymethyl)-4-oxo-3,4-dihydro-2H-1,3-thiazine-5-carbonitrile
Compound characteristics
| Compound ID: | 7218-1610 |
| Compound Name: | 6-(hexylsulfanyl)-2-(hydroxymethyl)-4-oxo-3,4-dihydro-2H-1,3-thiazine-5-carbonitrile |
| Molecular Weight: | 286.41 |
| Molecular Formula: | C12 H18 N2 O2 S2 |
| Smiles: | CCCCCCSC1=C(C#N)C(NC(CO)S1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1039 |
| logD: | 3.1036 |
| logSw: | -3.1084 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.355 |
| InChI Key: | NBNRWBKBKDZPDD-JTQLQIEISA-N |