ethyl 4-{[(2-methoxyphenyl)methyl]amino}-3-nitrobenzoate
Chemical Structure Depiction of
ethyl 4-{[(2-methoxyphenyl)methyl]amino}-3-nitrobenzoate
ethyl 4-{[(2-methoxyphenyl)methyl]amino}-3-nitrobenzoate
Compound characteristics
| Compound ID: | K781-0058 |
| Compound Name: | ethyl 4-{[(2-methoxyphenyl)methyl]amino}-3-nitrobenzoate |
| Molecular Weight: | 330.34 |
| Molecular Formula: | C17 H18 N2 O5 |
| Smiles: | CCOC(c1ccc(c(c1)[N+]([O-])=O)NCc1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0874 |
| logD: | 4.0874 |
| logSw: | -4.2884 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.24 |
| InChI Key: | BMHUYXZBMAWLCN-UHFFFAOYSA-N |