methyl 1'-ethyl-4'-nitro-1'H-[1,3'-bipyrazole]-4-carboxylate
Chemical Structure Depiction of
methyl 1'-ethyl-4'-nitro-1'H-[1,3'-bipyrazole]-4-carboxylate
methyl 1'-ethyl-4'-nitro-1'H-[1,3'-bipyrazole]-4-carboxylate
Compound characteristics
| Compound ID: | Y507-3887 |
| Compound Name: | methyl 1'-ethyl-4'-nitro-1'H-[1,3'-bipyrazole]-4-carboxylate |
| Molecular Weight: | 265.23 |
| Molecular Formula: | C10 H11 N5 O4 |
| Smiles: | CCn1cc(c(n1)n1cc(cn1)C(=O)OC)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.9528 |
| logD: | 0.9528 |
| logSw: | -1.0614 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 83.062 |
| InChI Key: | MAFUUSBNOBWDAE-UHFFFAOYSA-N |