1-benzyl-3-{4-[(4-ethoxyphenyl)acetyl]-1,4-diazepan-1-yl}pyrrolidin-2-one
Chemical Structure Depiction of
1-benzyl-3-{4-[(4-ethoxyphenyl)acetyl]-1,4-diazepan-1-yl}pyrrolidin-2-one
1-benzyl-3-{4-[(4-ethoxyphenyl)acetyl]-1,4-diazepan-1-yl}pyrrolidin-2-one
Compound characteristics
| Compound ID: | T991-0566 |
| Compound Name: | 1-benzyl-3-{4-[(4-ethoxyphenyl)acetyl]-1,4-diazepan-1-yl}pyrrolidin-2-one |
| Molecular Weight: | 435.57 |
| Molecular Formula: | C26 H33 N3 O3 |
| Smiles: | CCOc1ccc(CC(N2CCCN(CC2)C2CCN(Cc3ccccc3)C2=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7679 |
| logD: | 2.7526 |
| logSw: | -2.7552 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.165 |
| InChI Key: | KMSAXWWPFQFPHS-DEOSSOPVSA-N |