3-(8',9'-dimethyl-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline]-1-sulfonyl)benzonitrile
Chemical Structure Depiction of
3-(8',9'-dimethyl-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline]-1-sulfonyl)benzonitrile
3-(8',9'-dimethyl-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline]-1-sulfonyl)benzonitrile
Compound characteristics
| Compound ID: | F351-0953 |
| Compound Name: | 3-(8',9'-dimethyl-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxaline]-1-sulfonyl)benzonitrile |
| Molecular Weight: | 432.54 |
| Molecular Formula: | C24 H24 N4 O2 S |
| Smiles: | [H]N1c2ccc(C)c(C)c2n2cccc2C12CCN(CC2)S(c1cccc(C#N)c1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1384 |
| logD: | 5.1371 |
| logSw: | -5.1025 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.67 |
| InChI Key: | BMDRUPGAYFKBKC-UHFFFAOYSA-N |