[4-(3-chlorophenyl)piperazin-1-yl][3-(3-fluorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepin-1-yl]methanone
Chemical Structure Depiction of
[4-(3-chlorophenyl)piperazin-1-yl][3-(3-fluorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepin-1-yl]methanone
[4-(3-chlorophenyl)piperazin-1-yl][3-(3-fluorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepin-1-yl]methanone
Compound characteristics
| Compound ID: | E598-0538 |
| Compound Name: | [4-(3-chlorophenyl)piperazin-1-yl][3-(3-fluorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepin-1-yl]methanone |
| Molecular Weight: | 452.96 |
| Molecular Formula: | C25 H26 Cl F N4 O |
| Smiles: | C1CCc2c(C(N3CCN(CC3)c3cccc(c3)[Cl])=O)nc(c3cccc(c3)F)n2CC1 |
| Stereo: | ACHIRAL |
| logP: | 5.4706 |
| logD: | 5.4706 |
| logSw: | -5.9889 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 30.9877 |
| InChI Key: | TYUBOKUBEMTKHB-UHFFFAOYSA-N |