2-(2-amino-3-cyano-7,7-dimethyl-2',5-dioxo-5,6,7,8-tetrahydrospiro[[1]benzopyran-4,3'-indol]-1'(2'H)-yl)acetamide
Chemical Structure Depiction of
2-(2-amino-3-cyano-7,7-dimethyl-2',5-dioxo-5,6,7,8-tetrahydrospiro[[1]benzopyran-4,3'-indol]-1'(2'H)-yl)acetamide
2-(2-amino-3-cyano-7,7-dimethyl-2',5-dioxo-5,6,7,8-tetrahydrospiro[[1]benzopyran-4,3'-indol]-1'(2'H)-yl)acetamide
Compound characteristics
| Compound ID: | 5587-0188 |
| Compound Name: | 2-(2-amino-3-cyano-7,7-dimethyl-2',5-dioxo-5,6,7,8-tetrahydrospiro[[1]benzopyran-4,3'-indol]-1'(2'H)-yl)acetamide |
| Molecular Weight: | 392.41 |
| Molecular Formula: | C21 H20 N4 O4 |
| Smiles: | CC1(C)CC2=C(C(C1)=O)C1(C(C#N)=C(N)O2)C(N(CC(N)=O)c2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.5722 |
| logD: | 0.5722 |
| logSw: | -2.2669 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 108.73 |
| InChI Key: | MQZYNFMFBWBUFA-OAQYLSRUSA-N |