2-[(4-fluorophenyl)methyl]-9-(isoquinoline-1-carbonyl)octahydropyrazino[1,2-a][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
2-[(4-fluorophenyl)methyl]-9-(isoquinoline-1-carbonyl)octahydropyrazino[1,2-a][1,4]diazepine-1,4-dione
2-[(4-fluorophenyl)methyl]-9-(isoquinoline-1-carbonyl)octahydropyrazino[1,2-a][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | SD67-0602 |
| Compound Name: | 2-[(4-fluorophenyl)methyl]-9-(isoquinoline-1-carbonyl)octahydropyrazino[1,2-a][1,4]diazepine-1,4-dione |
| Molecular Weight: | 446.48 |
| Molecular Formula: | C25 H23 F N4 O3 |
| Smiles: | C1CN(CC2C(N(CC(N2C1)=O)Cc1ccc(cc1)F)=O)C(c1c2ccccc2ccn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.595 |
| logD: | 1.595 |
| logSw: | -2.1314 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.57 |
| InChI Key: | WPENWLVLHRRPPE-NRFANRHFSA-N |