4-acetyl-3-amino-5-pentylcyclopenta-2,4-diene-1,1,2-tricarbonitrile
Chemical Structure Depiction of
4-acetyl-3-amino-5-pentylcyclopenta-2,4-diene-1,1,2-tricarbonitrile
4-acetyl-3-amino-5-pentylcyclopenta-2,4-diene-1,1,2-tricarbonitrile
Compound characteristics
| Compound ID: | 8009-5806 |
| Compound Name: | 4-acetyl-3-amino-5-pentylcyclopenta-2,4-diene-1,1,2-tricarbonitrile |
| Molecular Weight: | 268.32 |
| Molecular Formula: | C15 H16 N4 O |
| Smiles: | CCCCCC1=C(C(=C(C#N)C1(C#N)C#N)N)C(C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.31 |
| logD: | 2.3099 |
| logSw: | -2.0031 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.899 |
| InChI Key: | JYYRXLRBXZIYLB-UHFFFAOYSA-N |