2-amino-6-(3-bromophenyl)-4,4-diethoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile
Chemical Structure Depiction of
2-amino-6-(3-bromophenyl)-4,4-diethoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile
2-amino-6-(3-bromophenyl)-4,4-diethoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile
Compound characteristics
| Compound ID: | 6234-0133 |
| Compound Name: | 2-amino-6-(3-bromophenyl)-4,4-diethoxy-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile |
| Molecular Weight: | 389.25 |
| Molecular Formula: | C17 H17 Br N4 O2 |
| Smiles: | CCOC1(C2(C#N)C(c3cccc(c3)[Br])C2(C#N)C(N)=N1)OCC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4113 |
| logD: | 0.5774 |
| logSw: | -3.5551 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.338 |
| InChI Key: | YOHWCWVJPIEOPB-UHFFFAOYSA-N |