N-[(2-bromophenyl)methyl]-1-oxo-2-(propan-2-yl)-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazole-8-carboxamide
Chemical Structure Depiction of
N-[(2-bromophenyl)methyl]-1-oxo-2-(propan-2-yl)-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazole-8-carboxamide
N-[(2-bromophenyl)methyl]-1-oxo-2-(propan-2-yl)-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazole-8-carboxamide
Compound characteristics
| Compound ID: | M617-0913 |
| Compound Name: | N-[(2-bromophenyl)methyl]-1-oxo-2-(propan-2-yl)-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazole-8-carboxamide |
| Molecular Weight: | 441.33 |
| Molecular Formula: | C21 H21 Br N4 O2 |
| Smiles: | CC(C)N1CCn2c3ccc(cc3nc2C1=O)C(NCc1ccccc1[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7538 |
| logD: | 3.7538 |
| logSw: | -3.9954 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.454 |
| InChI Key: | KBSOWQVSKFTZNH-UHFFFAOYSA-N |