4-amino-6-(3-bromophenyl)spiro[3-azabicyclo[3.1.0]hex-3-ene-2,2'-[1,3]dioxolane]-1,5-dicarbonitrile
Chemical Structure Depiction of
4-amino-6-(3-bromophenyl)spiro[3-azabicyclo[3.1.0]hex-3-ene-2,2'-[1,3]dioxolane]-1,5-dicarbonitrile
4-amino-6-(3-bromophenyl)spiro[3-azabicyclo[3.1.0]hex-3-ene-2,2'-[1,3]dioxolane]-1,5-dicarbonitrile
Compound characteristics
| Compound ID: | 8016-2008 |
| Compound Name: | 4-amino-6-(3-bromophenyl)spiro[3-azabicyclo[3.1.0]hex-3-ene-2,2'-[1,3]dioxolane]-1,5-dicarbonitrile |
| Molecular Weight: | 359.18 |
| Molecular Formula: | C15 H11 Br N4 O2 |
| Smiles: | C1COC2(C3(C#N)C(c4cccc(c4)[Br])C3(C#N)C(N)=N2)O1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.1357 |
| logD: | -1.0387 |
| logSw: | -2.4167 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.928 |
| InChI Key: | BRBSBPTUEICBIJ-UHFFFAOYSA-N |