methyl 4-[2-(4-nitro-1H-pyrazol-1-yl)propanamido]benzoate
Chemical Structure Depiction of
methyl 4-[2-(4-nitro-1H-pyrazol-1-yl)propanamido]benzoate
methyl 4-[2-(4-nitro-1H-pyrazol-1-yl)propanamido]benzoate
Compound characteristics
| Compound ID: | 8015-6118 |
| Compound Name: | methyl 4-[2-(4-nitro-1H-pyrazol-1-yl)propanamido]benzoate |
| Molecular Weight: | 318.29 |
| Molecular Formula: | C14 H14 N4 O5 |
| Smiles: | CC(C(Nc1ccc(cc1)C(=O)OC)=O)n1cc(cn1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5272 |
| logD: | 1.527 |
| logSw: | -2.1658 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.466 |
| InChI Key: | JPHSJXVFTYEXCI-VIFPVBQESA-N |