N-(3-methylbutyl)-1'-oxo-2'-[(oxolan-2-yl)methyl]-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
Chemical Structure Depiction of
N-(3-methylbutyl)-1'-oxo-2'-[(oxolan-2-yl)methyl]-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
N-(3-methylbutyl)-1'-oxo-2'-[(oxolan-2-yl)methyl]-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
Compound characteristics
| Compound ID: | Y044-2173 |
| Compound Name: | N-(3-methylbutyl)-1'-oxo-2'-[(oxolan-2-yl)methyl]-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide |
| Molecular Weight: | 398.55 |
| Molecular Formula: | C24 H34 N2 O3 |
| Smiles: | CC(C)CCNC(C1c2ccccc2C(N(CC2CCCO2)C12CCCC2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.464 |
| logD: | 3.464 |
| logSw: | -3.7178 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.176 |
| InChI Key: | WDQPKXWSADLADE-UHFFFAOYSA-N |