3-[4-(2-chlorobenzoyl)-1,4-diazepan-1-yl]-1-[(4-fluorophenyl)methyl]pyrrolidin-2-one
Chemical Structure Depiction of
3-[4-(2-chlorobenzoyl)-1,4-diazepan-1-yl]-1-[(4-fluorophenyl)methyl]pyrrolidin-2-one
3-[4-(2-chlorobenzoyl)-1,4-diazepan-1-yl]-1-[(4-fluorophenyl)methyl]pyrrolidin-2-one
Compound characteristics
| Compound ID: | T991-0887 |
| Compound Name: | 3-[4-(2-chlorobenzoyl)-1,4-diazepan-1-yl]-1-[(4-fluorophenyl)methyl]pyrrolidin-2-one |
| Molecular Weight: | 429.92 |
| Molecular Formula: | C23 H25 Cl F N3 O2 |
| Smiles: | C1CN(CCN(C1)C(c1ccccc1[Cl])=O)C1CCN(Cc2ccc(cc2)F)C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5627 |
| logD: | 2.5607 |
| logSw: | -3.373 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.569 |
| InChI Key: | QOONKHZIEOTHIG-NRFANRHFSA-N |