2-{[(4-fluorophenyl)methyl]sulfanyl}-1-(7'-methyl-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxalin]-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{[(4-fluorophenyl)methyl]sulfanyl}-1-(7'-methyl-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxalin]-1-yl)ethan-1-one
2-{[(4-fluorophenyl)methyl]sulfanyl}-1-(7'-methyl-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxalin]-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | F352-0388 |
| Compound Name: | 2-{[(4-fluorophenyl)methyl]sulfanyl}-1-(7'-methyl-5'H-spiro[piperidine-4,4'-pyrrolo[1,2-a]quinoxalin]-1-yl)ethan-1-one |
| Molecular Weight: | 435.56 |
| Molecular Formula: | C25 H26 F N3 O S |
| Smiles: | [H]N1c2cc(C)ccc2n2cccc2C12CCN(CC2)C(CSCc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8968 |
| logD: | 4.8967 |
| logSw: | -4.6005 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.8667 |
| InChI Key: | KZESKSKIRAJUMO-UHFFFAOYSA-N |