methyl rel-(4R,6R)-6-methyl-2-sulfanylidene-1,3-diazinane-4-carboxylate
Chemical Structure Depiction of
methyl rel-(4R,6R)-6-methyl-2-sulfanylidene-1,3-diazinane-4-carboxylate
methyl rel-(4R,6R)-6-methyl-2-sulfanylidene-1,3-diazinane-4-carboxylate
Compound characteristics
Compound ID: | 8008-9929 |
Compound Name: | methyl rel-(4R,6R)-6-methyl-2-sulfanylidene-1,3-diazinane-4-carboxylate |
Molecular Weight: | 188.24 |
Molecular Formula: | C7 H12 N2 O2 S |
Smiles: | C[C@H]1C[C@@H](C(=O)OC)NC(N1)=S |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 0.3223 |
logD: | 0.3223 |
logSw: | -1.5976 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 44.634 |
InChI Key: | XEWBOKNKDZRMRR-UHNVWZDZSA-N |