methyl 4-[4-(4-nitro-1H-pyrazol-1-yl)butanamido]benzoate
Chemical Structure Depiction of
methyl 4-[4-(4-nitro-1H-pyrazol-1-yl)butanamido]benzoate
methyl 4-[4-(4-nitro-1H-pyrazol-1-yl)butanamido]benzoate
Compound characteristics
| Compound ID: | 8015-8864 |
| Compound Name: | methyl 4-[4-(4-nitro-1H-pyrazol-1-yl)butanamido]benzoate |
| Molecular Weight: | 332.31 |
| Molecular Formula: | C15 H16 N4 O5 |
| Smiles: | COC(c1ccc(cc1)NC(CCCn1cc(cn1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1797 |
| logD: | 1.1792 |
| logSw: | -2.2203 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.427 |
| InChI Key: | XTXRIXXBXBCNRQ-UHFFFAOYSA-N |