1-[(4-fluorophenyl)methyl]-3-[4-(thiophene-3-carbonyl)-1,4-diazepan-1-yl]pyrrolidin-2-one
Chemical Structure Depiction of
1-[(4-fluorophenyl)methyl]-3-[4-(thiophene-3-carbonyl)-1,4-diazepan-1-yl]pyrrolidin-2-one
1-[(4-fluorophenyl)methyl]-3-[4-(thiophene-3-carbonyl)-1,4-diazepan-1-yl]pyrrolidin-2-one
Compound characteristics
| Compound ID: | T991-0840 |
| Compound Name: | 1-[(4-fluorophenyl)methyl]-3-[4-(thiophene-3-carbonyl)-1,4-diazepan-1-yl]pyrrolidin-2-one |
| Molecular Weight: | 401.5 |
| Molecular Formula: | C21 H24 F N3 O2 S |
| Smiles: | C1CN(CCN(C1)C(c1ccsc1)=O)C1CCN(Cc2ccc(cc2)F)C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9632 |
| logD: | 1.9612 |
| logSw: | -2.3033 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.587 |
| InChI Key: | NFNMUUPJFFVFFN-IBGZPJMESA-N |