rel-(4R,5R)-4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-[(4-fluorophenyl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-10-one
Chemical Structure Depiction of
rel-(4R,5R)-4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-[(4-fluorophenyl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-10-one
rel-(4R,5R)-4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-[(4-fluorophenyl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-10-one
Compound characteristics
| Compound ID: | SC77-0926 |
| Compound Name: | rel-(4R,5R)-4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-[(4-fluorophenyl)methyl]-6-oxa-2,9-diazaspiro[4.5]decan-10-one |
| Molecular Weight: | 423.49 |
| Molecular Formula: | C24 H26 F N3 O3 |
| Smiles: | C1CN(Cc2ccccc12)C([C@H]1CN(Cc2ccc(cc2)F)C[C@]12C(NCCO2)=O)=O |
| Stereo: | RELATIVE |
| logP: | 2.3769 |
| logD: | 2.0838 |
| logSw: | -2.7578 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.428 |
| InChI Key: | LOBHBGJVAVQYLS-QPPBQGQZSA-N |