2-amino-4-(3-bromophenyl)buta-1,3-diene-1,1,3-tricarbonitrile
Chemical Structure Depiction of
2-amino-4-(3-bromophenyl)buta-1,3-diene-1,1,3-tricarbonitrile
2-amino-4-(3-bromophenyl)buta-1,3-diene-1,1,3-tricarbonitrile
Compound characteristics
| Compound ID: | 8018-7742 |
| Compound Name: | 2-amino-4-(3-bromophenyl)buta-1,3-diene-1,1,3-tricarbonitrile |
| Molecular Weight: | 299.13 |
| Molecular Formula: | C13 H7 Br N4 |
| Smiles: | C(=C(C#N)/C(=C(C#N)C#N)N)\c1cccc(c1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.4793 |
| logD: | 2.4784 |
| logSw: | -2.4618 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.549 |
| InChI Key: | WPCDZYNVIQAGNO-UHFFFAOYSA-N |