N-[(2-bromophenyl)methyl]-2-propanoyl-1,2,3,4-tetrahydroisoquinoline-1-carboxamide
Chemical Structure Depiction of
N-[(2-bromophenyl)methyl]-2-propanoyl-1,2,3,4-tetrahydroisoquinoline-1-carboxamide
N-[(2-bromophenyl)methyl]-2-propanoyl-1,2,3,4-tetrahydroisoquinoline-1-carboxamide
Compound characteristics
| Compound ID: | P368-0461 |
| Compound Name: | N-[(2-bromophenyl)methyl]-2-propanoyl-1,2,3,4-tetrahydroisoquinoline-1-carboxamide |
| Molecular Weight: | 401.3 |
| Molecular Formula: | C20 H21 Br N2 O2 |
| Smiles: | [H]c1cccc2C(C(NCc3ccccc3[Br])=O)N(CCc12)C(CC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7501 |
| logD: | 3.7501 |
| logSw: | -3.8435 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.29 |
| InChI Key: | PUGWUTZGRBLCTP-LJQANCHMSA-N |