4-(1'-oxohexahydro-6'H-spiro[piperidine-4,7'-pyrrolo[1,2-a]pyrazine]-1-sulfonyl)benzonitrile
Chemical Structure Depiction of
4-(1'-oxohexahydro-6'H-spiro[piperidine-4,7'-pyrrolo[1,2-a]pyrazine]-1-sulfonyl)benzonitrile
4-(1'-oxohexahydro-6'H-spiro[piperidine-4,7'-pyrrolo[1,2-a]pyrazine]-1-sulfonyl)benzonitrile
Compound characteristics
| Compound ID: | S730-0265 |
| Compound Name: | 4-(1'-oxohexahydro-6'H-spiro[piperidine-4,7'-pyrrolo[1,2-a]pyrazine]-1-sulfonyl)benzonitrile |
| Molecular Weight: | 374.46 |
| Molecular Formula: | C18 H22 N4 O3 S |
| Smiles: | C1CN(CCC12CC1C(NCCN1C2)=O)S(c1ccc(C#N)cc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.6109 |
| logD: | -0.274 |
| logSw: | -2.455 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.464 |
| InChI Key: | LMFRGYYJPROWQB-MRXNPFEDSA-N |