2'-benzyl-1'-oxo-N-{3-[(propan-2-yl)oxy]propyl}-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
Chemical Structure Depiction of
2'-benzyl-1'-oxo-N-{3-[(propan-2-yl)oxy]propyl}-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
2'-benzyl-1'-oxo-N-{3-[(propan-2-yl)oxy]propyl}-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
Compound characteristics
| Compound ID: | J105-0161 |
| Compound Name: | 2'-benzyl-1'-oxo-N-{3-[(propan-2-yl)oxy]propyl}-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide |
| Molecular Weight: | 434.58 |
| Molecular Formula: | C27 H34 N2 O3 |
| Smiles: | CC(C)OCCCNC(C1c2ccccc2C(N(Cc2ccccc2)C12CCCC2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1611 |
| logD: | 4.1611 |
| logSw: | -4.2533 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.723 |
| InChI Key: | HJIJHRZJVVFYNN-DEOSSOPVSA-N |