2-amino-4-(3,4-dichlorophenyl)buta-1,3-diene-1,1,3-tricarbonitrile
Chemical Structure Depiction of
2-amino-4-(3,4-dichlorophenyl)buta-1,3-diene-1,1,3-tricarbonitrile
2-amino-4-(3,4-dichlorophenyl)buta-1,3-diene-1,1,3-tricarbonitrile
Compound characteristics
| Compound ID: | 8020-8163 |
| Compound Name: | 2-amino-4-(3,4-dichlorophenyl)buta-1,3-diene-1,1,3-tricarbonitrile |
| Molecular Weight: | 289.12 |
| Molecular Formula: | C13 H6 Cl2 N4 |
| Smiles: | C(=C(C#N)/C(=C(C#N)C#N)N)\c1ccc(c(c1)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.1003 |
| logD: | 3.0994 |
| logSw: | -3.5293 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.549 |
| InChI Key: | UYSHPBVAIHWEIM-UHFFFAOYSA-N |