1-{[4-(azepane-1-carbonyl)phenyl]methyl}-4-[(4-fluorophenyl)methyl]piperazine-2,3-dione
Chemical Structure Depiction of
1-{[4-(azepane-1-carbonyl)phenyl]methyl}-4-[(4-fluorophenyl)methyl]piperazine-2,3-dione
1-{[4-(azepane-1-carbonyl)phenyl]methyl}-4-[(4-fluorophenyl)methyl]piperazine-2,3-dione
Compound characteristics
| Compound ID: | M116-2288 |
| Compound Name: | 1-{[4-(azepane-1-carbonyl)phenyl]methyl}-4-[(4-fluorophenyl)methyl]piperazine-2,3-dione |
| Molecular Weight: | 437.51 |
| Molecular Formula: | C25 H28 F N3 O3 |
| Smiles: | C1CCCN(CC1)C(c1ccc(CN2CCN(Cc3ccc(cc3)F)C(C2=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.551 |
| logD: | 2.551 |
| logSw: | -2.5661 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.263 |
| InChI Key: | PQKYBHWXZAULKL-UHFFFAOYSA-N |