2-amino-4-(5-butylthiophen-2-yl)-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
Chemical Structure Depiction of
2-amino-4-(5-butylthiophen-2-yl)-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
2-amino-4-(5-butylthiophen-2-yl)-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
Compound characteristics
| Compound ID: | 8009-4798 |
| Compound Name: | 2-amino-4-(5-butylthiophen-2-yl)-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile |
| Molecular Weight: | 362.5 |
| Molecular Formula: | C21 H22 N4 S |
| Smiles: | CCCCc1ccc(C2C3CCCC=C3C(C#N)=C(C2(C#N)C#N)N)s1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.6817 |
| logD: | 4.6816 |
| logSw: | -4.5254 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.373 |
| InChI Key: | BKYUMPRMJATCSB-UHFFFAOYSA-N |