2'-(2-methylpropyl)-1'-oxo-N-(pyridin-4-yl)-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
Chemical Structure Depiction of
2'-(2-methylpropyl)-1'-oxo-N-(pyridin-4-yl)-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
2'-(2-methylpropyl)-1'-oxo-N-(pyridin-4-yl)-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide
Compound characteristics
| Compound ID: | J105-0013 |
| Compound Name: | 2'-(2-methylpropyl)-1'-oxo-N-(pyridin-4-yl)-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxamide |
| Molecular Weight: | 377.49 |
| Molecular Formula: | C23 H27 N3 O2 |
| Smiles: | CC(C)CN1C(c2ccccc2C(C(Nc2ccncc2)=O)C12CCCC2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6961 |
| logD: | 3.6189 |
| logSw: | -3.8919 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.787 |
| InChI Key: | KMRRRWHADJLAQR-FQEVSTJZSA-N |