5,5-dimethyl-2,3-dioxo-2,3,5,6-tetrahydropyrrolo[2,1-a]isoquinoline-1-carbonitrile
Chemical Structure Depiction of
5,5-dimethyl-2,3-dioxo-2,3,5,6-tetrahydropyrrolo[2,1-a]isoquinoline-1-carbonitrile
5,5-dimethyl-2,3-dioxo-2,3,5,6-tetrahydropyrrolo[2,1-a]isoquinoline-1-carbonitrile
Compound characteristics
| Compound ID: | 8014-1382 |
| Compound Name: | 5,5-dimethyl-2,3-dioxo-2,3,5,6-tetrahydropyrrolo[2,1-a]isoquinoline-1-carbonitrile |
| Molecular Weight: | 252.27 |
| Molecular Formula: | C15 H12 N2 O2 |
| Smiles: | CC1(C)Cc2ccccc2C2=C(C#N)C(C(N12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8914 |
| logD: | 1.8914 |
| logSw: | -2.5669 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.972 |
| InChI Key: | JYXUOZFZUZXYFR-UHFFFAOYSA-N |