[3-(3-fluorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepin-1-yl][4-(4-nitrophenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
[3-(3-fluorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepin-1-yl][4-(4-nitrophenyl)piperazin-1-yl]methanone
[3-(3-fluorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepin-1-yl][4-(4-nitrophenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | E598-0540 |
| Compound Name: | [3-(3-fluorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepin-1-yl][4-(4-nitrophenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 463.51 |
| Molecular Formula: | C25 H26 F N5 O3 |
| Smiles: | C1CCc2c(C(N3CCN(CC3)c3ccc(cc3)[N+]([O-])=O)=O)nc(c3cccc(c3)F)n2CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.9341 |
| logD: | 4.9341 |
| logSw: | -4.8536 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.369 |
| InChI Key: | FOASGQYLIZEYIR-UHFFFAOYSA-N |