N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
Chemical Structure Depiction of
N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide
Compound characteristics
| Compound ID: | E920-0223 |
| Compound Name: | N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-5,6,7,8-tetrahydro-4H-cyclohepta[d][1,2]oxazole-3-carboxamide |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C22 H29 F N4 O2 |
| Smiles: | C1CCc2c(C(NCCCN3CCN(CC3)c3ccc(cc3)F)=O)noc2CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.9998 |
| logD: | 2.4559 |
| logSw: | -3.262 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.467 |
| InChI Key: | RWXKELQJDWXVIQ-UHFFFAOYSA-N |