6,7-dimethyl-1,3-dioxo-4-phenyl-2,3-dihydropyrano[3,4-c]pyrrole-3a,7a(1H,4H)-dicarbonitrile
Chemical Structure Depiction of
6,7-dimethyl-1,3-dioxo-4-phenyl-2,3-dihydropyrano[3,4-c]pyrrole-3a,7a(1H,4H)-dicarbonitrile
6,7-dimethyl-1,3-dioxo-4-phenyl-2,3-dihydropyrano[3,4-c]pyrrole-3a,7a(1H,4H)-dicarbonitrile
Compound characteristics
| Compound ID: | 8020-7867 |
| Compound Name: | 6,7-dimethyl-1,3-dioxo-4-phenyl-2,3-dihydropyrano[3,4-c]pyrrole-3a,7a(1H,4H)-dicarbonitrile |
| Molecular Weight: | 307.31 |
| Molecular Formula: | C17 H13 N3 O3 |
| Smiles: | CC1=C(C)OC(c2ccccc2)C2(C#N)C(NC(C12C#N)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.7328 |
| logD: | 1.3507 |
| logSw: | -2.0668 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.847 |
| InChI Key: | CAEGORYZOAKZTC-UHFFFAOYSA-N |