2'-benzyl-N-(2-methylpropyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
Chemical Structure Depiction of
2'-benzyl-N-(2-methylpropyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
2'-benzyl-N-(2-methylpropyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
Compound characteristics
Compound ID: | J105-0058 |
Compound Name: | 2'-benzyl-N-(2-methylpropyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide |
Molecular Weight: | 390.53 |
Molecular Formula: | C25 H30 N2 O2 |
Smiles: | CC(C)CNC(C1c2ccccc2C(N(Cc2ccccc2)C12CCCC2)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.6652 |
logD: | 4.6652 |
logSw: | -4.3742 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 40.681 |
InChI Key: | NCNQEQCMKMEYDP-QFIPXVFZSA-N |