2-amino-5'-methyl-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[[1]benzopyran-4,3'-indole]-3-carbonitrile
Chemical Structure Depiction of
2-amino-5'-methyl-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[[1]benzopyran-4,3'-indole]-3-carbonitrile
2-amino-5'-methyl-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[[1]benzopyran-4,3'-indole]-3-carbonitrile
Compound characteristics
| Compound ID: | 8008-1719 |
| Compound Name: | 2-amino-5'-methyl-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[[1]benzopyran-4,3'-indole]-3-carbonitrile |
| Molecular Weight: | 321.33 |
| Molecular Formula: | C18 H15 N3 O3 |
| Smiles: | Cc1ccc2c(c1)C1(C(C#N)=C(N)OC3CCCC(C1=3)=O)C(N2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6293 |
| logD: | 1.6293 |
| logSw: | -2.425 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.846 |
| InChI Key: | FKRJJYXWUMEAKB-GOSISDBHSA-N |