1-(8b-hydroxy-3-methyl-2-sulfanylidene-2,3,3a,8b-tetrahydroimidazo[4,5-b]indol-4(1H)-yl)ethan-1-one
Chemical Structure Depiction of
1-(8b-hydroxy-3-methyl-2-sulfanylidene-2,3,3a,8b-tetrahydroimidazo[4,5-b]indol-4(1H)-yl)ethan-1-one
1-(8b-hydroxy-3-methyl-2-sulfanylidene-2,3,3a,8b-tetrahydroimidazo[4,5-b]indol-4(1H)-yl)ethan-1-one
Compound characteristics
Compound ID: | 8012-6877 |
Compound Name: | 1-(8b-hydroxy-3-methyl-2-sulfanylidene-2,3,3a,8b-tetrahydroimidazo[4,5-b]indol-4(1H)-yl)ethan-1-one |
Molecular Weight: | 263.32 |
Molecular Formula: | C12 H13 N3 O2 S |
Smiles: | CC(N1C2C(c3ccccc13)(NC(N2C)=S)O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 0.627 |
logD: | 0.627 |
logSw: | -2.2595 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 46.217 |
InChI Key: | YHDNSGJWWLLXGY-UHFFFAOYSA-N |