methyl 4-[2-(3-nitrobenzoyl)hydrazinyl]-4-oxobutanoate
Chemical Structure Depiction of
methyl 4-[2-(3-nitrobenzoyl)hydrazinyl]-4-oxobutanoate
methyl 4-[2-(3-nitrobenzoyl)hydrazinyl]-4-oxobutanoate
Compound characteristics
| Compound ID: | 1909-0362 |
| Compound Name: | methyl 4-[2-(3-nitrobenzoyl)hydrazinyl]-4-oxobutanoate |
| Molecular Weight: | 295.25 |
| Molecular Formula: | C12 H13 N3 O6 |
| Smiles: | COC(CCC(NNC(c1cccc(c1)[N+]([O-])=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3365 |
| logD: | 0.2988 |
| logSw: | -2.1383 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 105.453 |
| InChI Key: | FDEDGAOGWVZFNZ-UHFFFAOYSA-N |