2,4-dibutyl-1,8-dicyano-7-oxo-6-oxabicyclo[3.2.1]oct-3-ene-8-carboxamide
Chemical Structure Depiction of
2,4-dibutyl-1,8-dicyano-7-oxo-6-oxabicyclo[3.2.1]oct-3-ene-8-carboxamide
2,4-dibutyl-1,8-dicyano-7-oxo-6-oxabicyclo[3.2.1]oct-3-ene-8-carboxamide
Compound characteristics
| Compound ID: | 8020-8735 |
| Compound Name: | 2,4-dibutyl-1,8-dicyano-7-oxo-6-oxabicyclo[3.2.1]oct-3-ene-8-carboxamide |
| Molecular Weight: | 329.4 |
| Molecular Formula: | C18 H23 N3 O3 |
| Smiles: | CCCCC1C=C(CCCC)C2C(C#N)(C(N)=O)C1(C#N)C(=O)O2 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.1163 |
| logD: | 3.1163 |
| logSw: | -3.0708 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.813 |
| InChI Key: | PEZPODDRLOMMLO-UHFFFAOYSA-N |