2-sulfanylidene-1,2,3,5,6,7-hexahydro-4H-cyclopenta[d]pyrimidin-4-one
Chemical Structure Depiction of
2-sulfanylidene-1,2,3,5,6,7-hexahydro-4H-cyclopenta[d]pyrimidin-4-one
2-sulfanylidene-1,2,3,5,6,7-hexahydro-4H-cyclopenta[d]pyrimidin-4-one
Compound characteristics
| Compound ID: | C200-2836 |
| Compound Name: | 2-sulfanylidene-1,2,3,5,6,7-hexahydro-4H-cyclopenta[d]pyrimidin-4-one |
| Molecular Weight: | 168.21 |
| Molecular Formula: | C7 H8 N2 O S |
| Smiles: | C1CC2=C(C1)NC(NC2=O)=S |
| Stereo: | ACHIRAL |
| logP: | 0.911 |
| logD: | 0.876 |
| logSw: | -1.7446 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 36.441 |
| InChI Key: | BKZNWILEYOKDSL-UHFFFAOYSA-N |