4-(4-acetylanilino)-5-nitrobenzene-1,2-dicarbonitrile
Chemical Structure Depiction of
4-(4-acetylanilino)-5-nitrobenzene-1,2-dicarbonitrile
4-(4-acetylanilino)-5-nitrobenzene-1,2-dicarbonitrile
Compound characteristics
| Compound ID: | 3285-2456 |
| Compound Name: | 4-(4-acetylanilino)-5-nitrobenzene-1,2-dicarbonitrile |
| Molecular Weight: | 306.28 |
| Molecular Formula: | C16 H10 N4 O3 |
| Smiles: | CC(c1ccc(cc1)Nc1cc(C#N)c(C#N)cc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2934 |
| logD: | 3.2934 |
| logSw: | -3.8049 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.473 |
| InChI Key: | NWXPYICGTQTGFD-UHFFFAOYSA-N |