1-[(4-fluorophenyl)methyl]-3-{4-[(2-methylphenoxy)acetyl]-1,4-diazepan-1-yl}pyrrolidin-2-one
Chemical Structure Depiction of
1-[(4-fluorophenyl)methyl]-3-{4-[(2-methylphenoxy)acetyl]-1,4-diazepan-1-yl}pyrrolidin-2-one
1-[(4-fluorophenyl)methyl]-3-{4-[(2-methylphenoxy)acetyl]-1,4-diazepan-1-yl}pyrrolidin-2-one
Compound characteristics
Compound ID: | T991-0898 |
Compound Name: | 1-[(4-fluorophenyl)methyl]-3-{4-[(2-methylphenoxy)acetyl]-1,4-diazepan-1-yl}pyrrolidin-2-one |
Molecular Weight: | 439.53 |
Molecular Formula: | C25 H30 F N3 O3 |
Smiles: | Cc1ccccc1OCC(N1CCCN(CC1)C1CCN(Cc2ccc(cc2)F)C1=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.4046 |
logD: | 2.3904 |
logSw: | -2.4326 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 43.627 |
InChI Key: | RACSGCYRYGBFPM-JOCHJYFZSA-N |