methyl 3-[ethyl(phenyl)carbamoyl]-5-nitrobenzoate
Chemical Structure Depiction of
methyl 3-[ethyl(phenyl)carbamoyl]-5-nitrobenzoate
methyl 3-[ethyl(phenyl)carbamoyl]-5-nitrobenzoate
Compound characteristics
| Compound ID: | Y032-0084 |
| Compound Name: | methyl 3-[ethyl(phenyl)carbamoyl]-5-nitrobenzoate |
| Molecular Weight: | 328.32 |
| Molecular Formula: | C17 H16 N2 O5 |
| Smiles: | CCN(C(c1cc(cc(c1)[N+]([O-])=O)C(=O)OC)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.333 |
| logD: | 3.333 |
| logSw: | -3.6075 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.141 |
| InChI Key: | IZHYQVUDYYTEDI-UHFFFAOYSA-N |