8-benzyl-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide
Chemical Structure Depiction of
8-benzyl-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide
8-benzyl-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide
Compound characteristics
| Compound ID: | E616-0251 |
| Compound Name: | 8-benzyl-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-3-methyl-2-oxo-1-oxa-8-azaspiro[4.5]dec-3-ene-4-carboxamide |
| Molecular Weight: | 520.65 |
| Molecular Formula: | C30 H37 F N4 O3 |
| Smiles: | CC1=C(C(NCCCN2CCN(CC2)c2ccc(cc2)F)=O)C2(CCN(CC2)Cc2ccccc2)OC1=O |
| Stereo: | ACHIRAL |
| logP: | 3.2663 |
| logD: | 1.1636 |
| logSw: | -3.4551 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.102 |
| InChI Key: | WLVWAUVWBULCRT-UHFFFAOYSA-N |