3a,8a-dihydroxy-1-(prop-2-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-(prop-2-en-1-yl)-2-sulfanylidene-2,3,3a,8a-tetrahydroindeno[1,2-d]imidazol-8(1H)-one
3a,8a-dihydroxy-1-(prop-2-en-1-yl)-2-sulfanylidene-2,3,3a,8a-tetrahydroindeno[1,2-d]imidazol-8(1H)-one
Compound characteristics
| Compound ID: | 6623-0412 |
| Compound Name: | 3a,8a-dihydroxy-1-(prop-2-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=CCN1C(NC2(c3ccccc3C(C12O)=O)O)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.3668 |
| logD: | 1.3668 |
| logSw: | -2.3764 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 60.509 |
| InChI Key: | FSDLGUOYSZNNEO-UHFFFAOYSA-N |