2-amino-4,4-bis(ethylsulfanyl)-6-(3-methoxyphenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile
Chemical Structure Depiction of
2-amino-4,4-bis(ethylsulfanyl)-6-(3-methoxyphenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile
2-amino-4,4-bis(ethylsulfanyl)-6-(3-methoxyphenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile
Compound characteristics
| Compound ID: | 6234-0212 |
| Compound Name: | 2-amino-4,4-bis(ethylsulfanyl)-6-(3-methoxyphenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile |
| Molecular Weight: | 372.51 |
| Molecular Formula: | C18 H20 N4 O S2 |
| Smiles: | CCSC1(C2(C#N)C(c3cccc(c3)OC)C2(C#N)C(N)=N1)SCC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8458 |
| logD: | 1.3358 |
| logSw: | -4.1426 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.203 |
| InChI Key: | HMIJRXKBVDPECK-UHFFFAOYSA-N |