1-(4-hydroxy-4-methyl-2-sulfanylidene-1,3-diazinan-5-yl)ethan-1-one
Chemical Structure Depiction of
1-(4-hydroxy-4-methyl-2-sulfanylidene-1,3-diazinan-5-yl)ethan-1-one
1-(4-hydroxy-4-methyl-2-sulfanylidene-1,3-diazinan-5-yl)ethan-1-one
Compound characteristics
| Compound ID: | 8015-3662 |
| Compound Name: | 1-(4-hydroxy-4-methyl-2-sulfanylidene-1,3-diazinan-5-yl)ethan-1-one |
| Molecular Weight: | 188.24 |
| Molecular Formula: | C7 H12 N2 O2 S |
| Smiles: | CC(C1CNC(NC1(C)O)=S)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | -0.2305 |
| logD: | -0.2305 |
| logSw: | -1.6574 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 53.403 |
| InChI Key: | UTESIUDPKAPEEX-UHFFFAOYSA-N |