1-[(4-fluorophenyl)methyl]-3-[4-(3-methoxybenzoyl)-1,4-diazepan-1-yl]pyrrolidin-2-one
Chemical Structure Depiction of
1-[(4-fluorophenyl)methyl]-3-[4-(3-methoxybenzoyl)-1,4-diazepan-1-yl]pyrrolidin-2-one
1-[(4-fluorophenyl)methyl]-3-[4-(3-methoxybenzoyl)-1,4-diazepan-1-yl]pyrrolidin-2-one
Compound characteristics
| Compound ID: | T991-0752 |
| Compound Name: | 1-[(4-fluorophenyl)methyl]-3-[4-(3-methoxybenzoyl)-1,4-diazepan-1-yl]pyrrolidin-2-one |
| Molecular Weight: | 425.5 |
| Molecular Formula: | C24 H28 F N3 O3 |
| Smiles: | COc1cccc(c1)C(N1CCCN(CC1)C1CCN(Cc2ccc(cc2)F)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1268 |
| logD: | 2.1248 |
| logSw: | -2.5706 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.113 |
| InChI Key: | VUJMGNIFRQLUTQ-JOCHJYFZSA-N |