methyl 3-[ethyl(2-methylphenyl)carbamoyl]-5-nitrobenzoate
Chemical Structure Depiction of
methyl 3-[ethyl(2-methylphenyl)carbamoyl]-5-nitrobenzoate
methyl 3-[ethyl(2-methylphenyl)carbamoyl]-5-nitrobenzoate
Compound characteristics
| Compound ID: | 4130-4971 |
| Compound Name: | methyl 3-[ethyl(2-methylphenyl)carbamoyl]-5-nitrobenzoate |
| Molecular Weight: | 342.35 |
| Molecular Formula: | C18 H18 N2 O5 |
| Smiles: | CCN(C(c1cc(cc(c1)[N+]([O-])=O)C(=O)OC)=O)c1ccccc1C |
| Stereo: | ACHIRAL |
| logP: | 3.8368 |
| logD: | 3.8368 |
| logSw: | -4.0303 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.84 |
| InChI Key: | BCVJXCAUDHQSDY-UHFFFAOYSA-N |