7'-amino-1-ethyl-2,2',4'-trioxo-1,1',2,2',3',4'-hexahydrospiro[indole-3,5'-pyrano[2,3-d]pyrimidine]-6'-carbonitrile
Chemical Structure Depiction of
7'-amino-1-ethyl-2,2',4'-trioxo-1,1',2,2',3',4'-hexahydrospiro[indole-3,5'-pyrano[2,3-d]pyrimidine]-6'-carbonitrile
7'-amino-1-ethyl-2,2',4'-trioxo-1,1',2,2',3',4'-hexahydrospiro[indole-3,5'-pyrano[2,3-d]pyrimidine]-6'-carbonitrile
Compound characteristics
| Compound ID: | 8012-3988 |
| Compound Name: | 7'-amino-1-ethyl-2,2',4'-trioxo-1,1',2,2',3',4'-hexahydrospiro[indole-3,5'-pyrano[2,3-d]pyrimidine]-6'-carbonitrile |
| Molecular Weight: | 351.32 |
| Molecular Formula: | C17 H13 N5 O4 |
| Smiles: | CCN1C(C2(C(C#N)=C(N)OC3=C2C(NC(N3)=O)=O)c2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.1505 |
| logD: | 0.1262 |
| logSw: | -2.3497 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 111.654 |
| InChI Key: | KWCNJGIYSDMLSS-QGZVFWFLSA-N |