4-nitro-5-[4-(1H-pyrrol-1-yl)phenoxy]benzene-1,2-dicarbonitrile
Chemical Structure Depiction of
4-nitro-5-[4-(1H-pyrrol-1-yl)phenoxy]benzene-1,2-dicarbonitrile
4-nitro-5-[4-(1H-pyrrol-1-yl)phenoxy]benzene-1,2-dicarbonitrile
Compound characteristics
| Compound ID: | 8016-4974 |
| Compound Name: | 4-nitro-5-[4-(1H-pyrrol-1-yl)phenoxy]benzene-1,2-dicarbonitrile |
| Molecular Weight: | 330.3 |
| Molecular Formula: | C18 H10 N4 O3 |
| Smiles: | C(c1cc(c(cc1C#N)Oc1ccc(cc1)n1cccc1)[N+]([O-])=O)#N |
| Stereo: | ACHIRAL |
| logP: | 3.8562 |
| logD: | 3.8562 |
| logSw: | -4.2376 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 78.252 |
| InChI Key: | RLUOZBFIWZSMBL-UHFFFAOYSA-N |