1-benzyl-3-{4-[3-(2-methoxyphenyl)propanoyl]-1,4-diazepan-1-yl}pyrrolidin-2-one
Chemical Structure Depiction of
1-benzyl-3-{4-[3-(2-methoxyphenyl)propanoyl]-1,4-diazepan-1-yl}pyrrolidin-2-one
1-benzyl-3-{4-[3-(2-methoxyphenyl)propanoyl]-1,4-diazepan-1-yl}pyrrolidin-2-one
Compound characteristics
| Compound ID: | T991-0557 |
| Compound Name: | 1-benzyl-3-{4-[3-(2-methoxyphenyl)propanoyl]-1,4-diazepan-1-yl}pyrrolidin-2-one |
| Molecular Weight: | 435.57 |
| Molecular Formula: | C26 H33 N3 O3 |
| Smiles: | COc1ccccc1CCC(N1CCCN(CC1)C1CCN(Cc2ccccc2)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6957 |
| logD: | 2.6826 |
| logSw: | -2.7115 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.672 |
| InChI Key: | VVOATMITRPXKNN-QHCPKHFHSA-N |