methyl 3-nitro-5-(4-phenylpiperazine-1-carbonyl)benzoate
Chemical Structure Depiction of
methyl 3-nitro-5-(4-phenylpiperazine-1-carbonyl)benzoate
methyl 3-nitro-5-(4-phenylpiperazine-1-carbonyl)benzoate
Compound characteristics
| Compound ID: | Y032-0035 |
| Compound Name: | methyl 3-nitro-5-(4-phenylpiperazine-1-carbonyl)benzoate |
| Molecular Weight: | 369.38 |
| Molecular Formula: | C19 H19 N3 O5 |
| Smiles: | COC(c1cc(cc(c1)[N+]([O-])=O)C(N1CCN(CC1)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7877 |
| logD: | 2.7877 |
| logSw: | -3.2212 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.702 |
| InChI Key: | LSNRHGUSUAJJSV-UHFFFAOYSA-N |