2-benzyl-9-[(5-bromofuran-2-yl)methyl]octahydropyrazino[1,2-a][1,4]diazepine-1,4-dione
Chemical Structure Depiction of
2-benzyl-9-[(5-bromofuran-2-yl)methyl]octahydropyrazino[1,2-a][1,4]diazepine-1,4-dione
2-benzyl-9-[(5-bromofuran-2-yl)methyl]octahydropyrazino[1,2-a][1,4]diazepine-1,4-dione
Compound characteristics
| Compound ID: | SD67-0503 |
| Compound Name: | 2-benzyl-9-[(5-bromofuran-2-yl)methyl]octahydropyrazino[1,2-a][1,4]diazepine-1,4-dione |
| Molecular Weight: | 432.32 |
| Molecular Formula: | C20 H22 Br N3 O3 |
| Smiles: | C1CN(CC2C(N(CC(N2C1)=O)Cc1ccccc1)=O)Cc1ccc(o1)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7977 |
| logD: | 1.7599 |
| logSw: | -1.9738 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.204 |
| InChI Key: | QGLBCISRAQATKH-KRWDZBQOSA-N |