N-{[3-(4-methoxyanilino)but-2-enoyl]oxy}-4-nitrobenzamide
Chemical Structure Depiction of
N-{[3-(4-methoxyanilino)but-2-enoyl]oxy}-4-nitrobenzamide
N-{[3-(4-methoxyanilino)but-2-enoyl]oxy}-4-nitrobenzamide
Compound characteristics
| Compound ID: | 3896-0147 |
| Compound Name: | N-{[3-(4-methoxyanilino)but-2-enoyl]oxy}-4-nitrobenzamide |
| Molecular Weight: | 371.35 |
| Molecular Formula: | C18 H17 N3 O6 |
| Smiles: | C/C(=C/C(=O)ONC(c1ccc(cc1)[N+]([O-])=O)=O)Nc1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 2.2042 |
| logD: | -1.2147 |
| logSw: | -2.8369 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95 |
| InChI Key: | LLOAZNMRTRGILC-UHFFFAOYSA-N |