3a,8a-dihydroxy-1-[(1E)-prop-1-en-1-yl]-2-sulfanylidene-2,3,3a,8a-tetrahydroindeno[1,2-d]imidazol-8(1H)-one
Chemical Structure Depiction of
3a,8a-dihydroxy-1-[(1E)-prop-1-en-1-yl]-2-sulfanylidene-2,3,3a,8a-tetrahydroindeno[1,2-d]imidazol-8(1H)-one
3a,8a-dihydroxy-1-[(1E)-prop-1-en-1-yl]-2-sulfanylidene-2,3,3a,8a-tetrahydroindeno[1,2-d]imidazol-8(1H)-one
Compound characteristics
| Compound ID: | 3698-0160 |
| Compound Name: | 3a,8a-dihydroxy-1-[(1E)-prop-1-en-1-yl]-2-sulfanylidene-2,3,3a,8a-tetrahydroindeno[1,2-d]imidazol-8(1H)-one |
| Molecular Weight: | 276.31 |
| Molecular Formula: | C13 H12 N2 O3 S |
| Smiles: | C/C=C/N1C(NC2(c3ccccc3C(C12O)=O)O)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.285 |
| logD: | 1.285 |
| logSw: | -2.2848 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 60.142 |
| InChI Key: | ZYRNUOHWJBPUOK-FARCUNLSSA-N |