2-(4-cyclohexyl-5-sulfanylidene-4,5-dihydro-1H-tetrazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one
Chemical Structure Depiction of
2-(4-cyclohexyl-5-sulfanylidene-4,5-dihydro-1H-tetrazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one
2-(4-cyclohexyl-5-sulfanylidene-4,5-dihydro-1H-tetrazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one
Compound characteristics
| Compound ID: | 8009-6191 |
| Compound Name: | 2-(4-cyclohexyl-5-sulfanylidene-4,5-dihydro-1H-tetrazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one |
| Molecular Weight: | 310.37 |
| Molecular Formula: | C13 H18 N4 O3 S |
| Smiles: | C1CCC(CC1)N1C(N(C2CC(C3OCC2O3)=O)N=N1)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.0229 |
| logD: | 2.0229 |
| logSw: | -2.0823 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.307 |
| InChI Key: | OSLIUMOXEHSZFA-UHFFFAOYSA-N |