2-bromo-N-(1,2-dihydroacenaphthylen-5-yl)-5-nitrobenzamide
Chemical Structure Depiction of
2-bromo-N-(1,2-dihydroacenaphthylen-5-yl)-5-nitrobenzamide
2-bromo-N-(1,2-dihydroacenaphthylen-5-yl)-5-nitrobenzamide
Compound characteristics
| Compound ID: | 2072-0831 |
| Compound Name: | 2-bromo-N-(1,2-dihydroacenaphthylen-5-yl)-5-nitrobenzamide |
| Molecular Weight: | 397.23 |
| Molecular Formula: | C19 H13 Br N2 O3 |
| Smiles: | C1Cc2ccc(c3cccc1c23)NC(c1cc(ccc1[Br])[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2299 |
| logD: | 4.5365 |
| logSw: | -5.8555 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.028 |
| InChI Key: | XTPPEBQBDSDBSK-UHFFFAOYSA-N |