2'-benzyl-N-[(oxan-4-yl)methyl]-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
Chemical Structure Depiction of
2'-benzyl-N-[(oxan-4-yl)methyl]-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
2'-benzyl-N-[(oxan-4-yl)methyl]-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
Compound characteristics
| Compound ID: | J105-0148 |
| Compound Name: | 2'-benzyl-N-[(oxan-4-yl)methyl]-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide |
| Molecular Weight: | 432.56 |
| Molecular Formula: | C27 H32 N2 O3 |
| Smiles: | C1CCC2(C1)C(C(NCC1CCOCC1)=O)c1ccccc1C(N2Cc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.218 |
| logD: | 4.218 |
| logSw: | -4.4674 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.51 |
| InChI Key: | SSNQZXDJOQXEJQ-DEOSSOPVSA-N |