methyl 4-[(3-nitropyridin-2-yl)amino]benzoate
Chemical Structure Depiction of
methyl 4-[(3-nitropyridin-2-yl)amino]benzoate
methyl 4-[(3-nitropyridin-2-yl)amino]benzoate
Compound characteristics
| Compound ID: | C798-0494 |
| Compound Name: | methyl 4-[(3-nitropyridin-2-yl)amino]benzoate |
| Molecular Weight: | 273.25 |
| Molecular Formula: | C13 H11 N3 O4 |
| Smiles: | COC(c1ccc(cc1)Nc1c(cccn1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8432 |
| logD: | 2.8432 |
| logSw: | -3.5366 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.093 |
| InChI Key: | FYBCBOVGEYFNKE-UHFFFAOYSA-N |