methyl 4,6-dioxo-5-phenyl-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Chemical Structure Depiction of
methyl 4,6-dioxo-5-phenyl-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
methyl 4,6-dioxo-5-phenyl-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | 8006-4136 |
| Compound Name: | methyl 4,6-dioxo-5-phenyl-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate |
| Molecular Weight: | 273.25 |
| Molecular Formula: | C13 H11 N3 O4 |
| Smiles: | COC(C1C2C(C(N(C2=O)c2ccccc2)=O)NN=1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.0835 |
| logD: | -0.2515 |
| logSw: | -1.6742 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.328 |
| InChI Key: | ITXFNELSVHJYDM-UHFFFAOYSA-N |