rel-(4R,5R)-4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-(methanesulfonyl)-6-oxa-2,9-diazaspiro[4.5]decan-10-one
Chemical Structure Depiction of
rel-(4R,5R)-4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-(methanesulfonyl)-6-oxa-2,9-diazaspiro[4.5]decan-10-one
rel-(4R,5R)-4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-(methanesulfonyl)-6-oxa-2,9-diazaspiro[4.5]decan-10-one
Compound characteristics
| Compound ID: | SC77-0726 |
| Compound Name: | rel-(4R,5R)-4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-(methanesulfonyl)-6-oxa-2,9-diazaspiro[4.5]decan-10-one |
| Molecular Weight: | 440.49 |
| Molecular Formula: | C19 H25 F N4 O5 S |
| Smiles: | CS(N1C[C@H](C(N2CCN(CC2)c2ccc(cc2)F)=O)[C@]2(C1)C(NCCO2)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.2737 |
| logD: | 0.2737 |
| logSw: | -2.3311 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.769 |
| InChI Key: | XIRNIPVOHQYOOF-LPHOPBHVSA-N |