1-benzyl-3-[4-(2-fluorobenzoyl)-1,4-diazepan-1-yl]pyrrolidin-2-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-benzyl-3-[4-(2-fluorobenzoyl)-1,4-diazepan-1-yl]pyrrolidin-2-one--hydrogen chloride (1/1)
1-benzyl-3-[4-(2-fluorobenzoyl)-1,4-diazepan-1-yl]pyrrolidin-2-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | T991-0474 |
| Compound Name: | 1-benzyl-3-[4-(2-fluorobenzoyl)-1,4-diazepan-1-yl]pyrrolidin-2-one--hydrogen chloride (1/1) |
| Molecular Weight: | 431.94 |
| Molecular Formula: | C23 H26 F N3 O2 |
| Salt: | HCl |
| Smiles: | C1CN(CCN(C1)C(c1ccccc1F)=O)C1CCN(Cc2ccccc2)C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2552 |
| logD: | 2.2532 |
| logSw: | -2.842 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.569 |
| InChI Key: | IRYGKPOVIDGENB-NRFANRHFSA-N |