3-bromo-1,8,8-trimethyl-6-oxo-2,7-diazabicyclo[3.2.1]oct-3-ene-4,5-dicarbonitrile
Chemical Structure Depiction of
3-bromo-1,8,8-trimethyl-6-oxo-2,7-diazabicyclo[3.2.1]oct-3-ene-4,5-dicarbonitrile
3-bromo-1,8,8-trimethyl-6-oxo-2,7-diazabicyclo[3.2.1]oct-3-ene-4,5-dicarbonitrile
Compound characteristics
| Compound ID: | 8019-8341 |
| Compound Name: | 3-bromo-1,8,8-trimethyl-6-oxo-2,7-diazabicyclo[3.2.1]oct-3-ene-4,5-dicarbonitrile |
| Molecular Weight: | 295.14 |
| Molecular Formula: | C11 H11 Br N4 O |
| Smiles: | CC1(C)C2(C#N)C(C#N)=C(NC1(C)NC2=O)[Br] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.4969 |
| logD: | 1.4969 |
| logSw: | -1.8244 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.066 |
| InChI Key: | CGEWWTTYYKFYTQ-UHFFFAOYSA-N |