2-amino-6-(2-bromophenyl)-4,4-bis(ethylsulfanyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile
Chemical Structure Depiction of
2-amino-6-(2-bromophenyl)-4,4-bis(ethylsulfanyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile
2-amino-6-(2-bromophenyl)-4,4-bis(ethylsulfanyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile
Compound characteristics
| Compound ID: | 8017-3373 |
| Compound Name: | 2-amino-6-(2-bromophenyl)-4,4-bis(ethylsulfanyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile |
| Molecular Weight: | 421.38 |
| Molecular Formula: | C17 H17 Br N4 S2 |
| Smiles: | CCSC1(C2(C#N)C(c3ccccc3[Br])C2(C#N)C(N)=N1)SCC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4198 |
| logD: | 2.5803 |
| logSw: | -4.4646 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.659 |
| InChI Key: | PNKOJZWIWPTZQO-UHFFFAOYSA-N |