2-[(4-fluorophenyl)methyl]-N-[(furan-2-yl)methyl]-1-oxooctahydropyrazino[1,2-d][1,4]diazepine-8(2H)-carboxamide
Chemical Structure Depiction of
2-[(4-fluorophenyl)methyl]-N-[(furan-2-yl)methyl]-1-oxooctahydropyrazino[1,2-d][1,4]diazepine-8(2H)-carboxamide
2-[(4-fluorophenyl)methyl]-N-[(furan-2-yl)methyl]-1-oxooctahydropyrazino[1,2-d][1,4]diazepine-8(2H)-carboxamide
Compound characteristics
| Compound ID: | S994-0893 |
| Compound Name: | 2-[(4-fluorophenyl)methyl]-N-[(furan-2-yl)methyl]-1-oxooctahydropyrazino[1,2-d][1,4]diazepine-8(2H)-carboxamide |
| Molecular Weight: | 400.45 |
| Molecular Formula: | C21 H25 F N4 O3 |
| Smiles: | C1CN(CCN2CCN(Cc3ccc(cc3)F)C(C12)=O)C(NCc1ccco1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6922 |
| logD: | 1.5128 |
| logSw: | -2.0548 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.694 |
| InChI Key: | AFOJXJXXNAGGBR-IBGZPJMESA-N |