10-chloro-N-[4-(heptyloxy)phenyl]-4-oxo-1,3,4,6,7,11b-hexahydro-2H-pyrazino[2,1-a]isoquinoline-2-carboxamide
Chemical Structure Depiction of
10-chloro-N-[4-(heptyloxy)phenyl]-4-oxo-1,3,4,6,7,11b-hexahydro-2H-pyrazino[2,1-a]isoquinoline-2-carboxamide
10-chloro-N-[4-(heptyloxy)phenyl]-4-oxo-1,3,4,6,7,11b-hexahydro-2H-pyrazino[2,1-a]isoquinoline-2-carboxamide
Compound characteristics
| Compound ID: | V011-8214 |
| Compound Name: | 10-chloro-N-[4-(heptyloxy)phenyl]-4-oxo-1,3,4,6,7,11b-hexahydro-2H-pyrazino[2,1-a]isoquinoline-2-carboxamide |
| Molecular Weight: | 470.01 |
| Molecular Formula: | C26 H32 Cl N3 O3 |
| Smiles: | CCCCCCCOc1ccc(cc1)NC(N1CC2c3cc(ccc3CCN2C(C1)=O)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3278 |
| logD: | 6.3278 |
| logSw: | -6.0123 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.233 |
| InChI Key: | OANWDUWWUBNCMY-DEOSSOPVSA-N |