methyl 3-[(2-fluoro-5-nitrophenyl)carbamoyl]-5-nitrobenzoate
Chemical Structure Depiction of
methyl 3-[(2-fluoro-5-nitrophenyl)carbamoyl]-5-nitrobenzoate
methyl 3-[(2-fluoro-5-nitrophenyl)carbamoyl]-5-nitrobenzoate
Compound characteristics
| Compound ID: | Y032-0101 |
| Compound Name: | methyl 3-[(2-fluoro-5-nitrophenyl)carbamoyl]-5-nitrobenzoate |
| Molecular Weight: | 363.26 |
| Molecular Formula: | C15 H10 F N3 O7 |
| Smiles: | COC(c1cc(cc(c1)[N+]([O-])=O)C(Nc1cc(ccc1F)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3762 |
| logD: | 1.1233 |
| logSw: | -3.7514 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 110.569 |
| InChI Key: | NYCDASDKBZMRMZ-UHFFFAOYSA-N |