methyl N-(2'-cyclopentyl-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carbonyl)glycinate
Chemical Structure Depiction of
methyl N-(2'-cyclopentyl-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carbonyl)glycinate
methyl N-(2'-cyclopentyl-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carbonyl)glycinate
Compound characteristics
| Compound ID: | J104-0057 |
| Compound Name: | methyl N-(2'-cyclopentyl-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carbonyl)glycinate |
| Molecular Weight: | 398.5 |
| Molecular Formula: | C23 H30 N2 O4 |
| Smiles: | COC(CNC(C1c2ccccc2C(N(C2CCCC2)C12CCCCC2)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0111 |
| logD: | 3.0111 |
| logSw: | -3.4364 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.481 |
| InChI Key: | NXEWVIUGFFWBCJ-FQEVSTJZSA-N |