2'-cyclohexyl-N-[(3-fluorophenyl)methyl]-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
Chemical Structure Depiction of
2'-cyclohexyl-N-[(3-fluorophenyl)methyl]-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
2'-cyclohexyl-N-[(3-fluorophenyl)methyl]-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
Compound characteristics
| Compound ID: | Y044-3759 |
| Compound Name: | 2'-cyclohexyl-N-[(3-fluorophenyl)methyl]-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide |
| Molecular Weight: | 434.55 |
| Molecular Formula: | C27 H31 F N2 O2 |
| Smiles: | C1CCC(CC1)N1C(c2ccccc2C(C(NCc2cccc(c2)F)=O)C12CCCC2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9619 |
| logD: | 4.9618 |
| logSw: | -4.7871 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.631 |
| InChI Key: | MCUWFXYWYMWXJF-XMMPIXPASA-N |