methyl 3-[(2-chlorophenyl)carbamoyl]-5-nitrobenzoate
Chemical Structure Depiction of
methyl 3-[(2-chlorophenyl)carbamoyl]-5-nitrobenzoate
methyl 3-[(2-chlorophenyl)carbamoyl]-5-nitrobenzoate
Compound characteristics
| Compound ID: | Y032-0069 |
| Compound Name: | methyl 3-[(2-chlorophenyl)carbamoyl]-5-nitrobenzoate |
| Molecular Weight: | 334.71 |
| Molecular Formula: | C15 H11 Cl N2 O5 |
| Smiles: | COC(c1cc(cc(c1)[N+]([O-])=O)C(Nc1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3861 |
| logD: | 3.232 |
| logSw: | -3.7911 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.187 |
| InChI Key: | GHDQRFMDEUNNJM-UHFFFAOYSA-N |