2'-cyclopentyl-1'-oxo-N-[(oxolan-2-yl)methyl]-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide
Chemical Structure Depiction of
2'-cyclopentyl-1'-oxo-N-[(oxolan-2-yl)methyl]-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide
2'-cyclopentyl-1'-oxo-N-[(oxolan-2-yl)methyl]-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide
Compound characteristics
| Compound ID: | Y043-3309 |
| Compound Name: | 2'-cyclopentyl-1'-oxo-N-[(oxolan-2-yl)methyl]-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide |
| Molecular Weight: | 410.56 |
| Molecular Formula: | C25 H34 N2 O3 |
| Smiles: | C1CCC2(CC1)C(C(NCC1CCCO1)=O)c1ccccc1C(N2C1CCCC1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5895 |
| logD: | 3.5895 |
| logSw: | -3.7739 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.285 |
| InChI Key: | YPKJYAVHQGPKGX-UHFFFAOYSA-N |