4-[3'-(tert-butylamino)-1'H-spiro[piperidine-3,2'-quinoxaline]-1-carbonyl]benzonitrile
Chemical Structure Depiction of
4-[3'-(tert-butylamino)-1'H-spiro[piperidine-3,2'-quinoxaline]-1-carbonyl]benzonitrile
4-[3'-(tert-butylamino)-1'H-spiro[piperidine-3,2'-quinoxaline]-1-carbonyl]benzonitrile
Compound characteristics
| Compound ID: | S019-2113 |
| Compound Name: | 4-[3'-(tert-butylamino)-1'H-spiro[piperidine-3,2'-quinoxaline]-1-carbonyl]benzonitrile |
| Molecular Weight: | 401.51 |
| Molecular Formula: | C24 H27 N5 O |
| Smiles: | CC(C)(C)NC1C2(CCCN(C2)C(c2ccc(C#N)cc2)=O)Nc2ccccc2N=1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1163 |
| logD: | 3.1137 |
| logSw: | -3.3008 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.77 |
| InChI Key: | USAKMYBFKNHZMO-DEOSSOPVSA-N |