2'-butyl-N-[2-(4-methoxyphenyl)ethyl]-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide
Chemical Structure Depiction of
2'-butyl-N-[2-(4-methoxyphenyl)ethyl]-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide
2'-butyl-N-[2-(4-methoxyphenyl)ethyl]-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide
Compound characteristics
| Compound ID: | J104-0325 |
| Compound Name: | 2'-butyl-N-[2-(4-methoxyphenyl)ethyl]-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxamide |
| Molecular Weight: | 448.61 |
| Molecular Formula: | C28 H36 N2 O3 |
| Smiles: | CCCCN1C(c2ccccc2C(C(NCCc2ccc(cc2)OC)=O)C12CCCCC2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.074 |
| logD: | 5.074 |
| logSw: | -4.5433 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.678 |
| InChI Key: | SVJBBWWQVASNME-VWLOTQADSA-N |