1-[(4-fluorophenyl)methyl]-3-{4-[(3-methylphenyl)acetyl]-1,4-diazepan-1-yl}pyrrolidin-2-one
Chemical Structure Depiction of
1-[(4-fluorophenyl)methyl]-3-{4-[(3-methylphenyl)acetyl]-1,4-diazepan-1-yl}pyrrolidin-2-one
1-[(4-fluorophenyl)methyl]-3-{4-[(3-methylphenyl)acetyl]-1,4-diazepan-1-yl}pyrrolidin-2-one
Compound characteristics
| Compound ID: | T991-0901 |
| Compound Name: | 1-[(4-fluorophenyl)methyl]-3-{4-[(3-methylphenyl)acetyl]-1,4-diazepan-1-yl}pyrrolidin-2-one |
| Molecular Weight: | 423.53 |
| Molecular Formula: | C25 H30 F N3 O2 |
| Smiles: | Cc1cccc(CC(N2CCCN(CC2)C2CCN(Cc3ccc(cc3)F)C2=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1202 |
| logD: | 3.1048 |
| logSw: | -2.9937 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.042 |
| InChI Key: | JTIDMDHWGAWBIT-UHFFFAOYSA-N |