1-(4-{4-[3-(3-fluorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carbonyl]piperazin-1-yl}phenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-{4-[3-(3-fluorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carbonyl]piperazin-1-yl}phenyl)ethan-1-one
1-(4-{4-[3-(3-fluorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carbonyl]piperazin-1-yl}phenyl)ethan-1-one
Compound characteristics
| Compound ID: | E598-0655 |
| Compound Name: | 1-(4-{4-[3-(3-fluorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carbonyl]piperazin-1-yl}phenyl)ethan-1-one |
| Molecular Weight: | 460.55 |
| Molecular Formula: | C27 H29 F N4 O2 |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)C(c1c2CCCCCn2c(c2cccc(c2)F)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5506 |
| logD: | 4.5506 |
| logSw: | -4.3457 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.814 |
| InChI Key: | ZRAIWSRVLLLPBK-UHFFFAOYSA-N |