10-chloro-N-(2,4-dibromo-6-fluorophenyl)-4-oxo-1,3,4,6,7,11b-hexahydro-2H-pyrazino[2,1-a]isoquinoline-2-carboxamide
Chemical Structure Depiction of
10-chloro-N-(2,4-dibromo-6-fluorophenyl)-4-oxo-1,3,4,6,7,11b-hexahydro-2H-pyrazino[2,1-a]isoquinoline-2-carboxamide
10-chloro-N-(2,4-dibromo-6-fluorophenyl)-4-oxo-1,3,4,6,7,11b-hexahydro-2H-pyrazino[2,1-a]isoquinoline-2-carboxamide
Compound characteristics
| Compound ID: | V006-3766 |
| Compound Name: | 10-chloro-N-(2,4-dibromo-6-fluorophenyl)-4-oxo-1,3,4,6,7,11b-hexahydro-2H-pyrazino[2,1-a]isoquinoline-2-carboxamide |
| Molecular Weight: | 531.6 |
| Molecular Formula: | C19 H15 Br2 Cl F N3 O2 |
| Smiles: | C1CN2C(CN(CC2=O)C(Nc2c(cc(cc2[Br])[Br])F)=O)c2cc(ccc12)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7789 |
| logD: | 4.7659 |
| logSw: | -4.912 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.42 |
| InChI Key: | MTFHHSKLJGVORR-INIZCTEOSA-N |