1-tert-butyl-4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)pyrrolidin-2-one
Chemical Structure Depiction of
1-tert-butyl-4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)pyrrolidin-2-one
1-tert-butyl-4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | Y031-3999 |
| Compound Name: | 1-tert-butyl-4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)pyrrolidin-2-one |
| Molecular Weight: | 300.4 |
| Molecular Formula: | C18 H24 N2 O2 |
| Smiles: | CC(C)(C)N1CC(CC1=O)C(N1CCc2ccccc2C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1216 |
| logD: | 2.1216 |
| logSw: | -2.432 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.265 |
| InChI Key: | MBRAJBLMRVRRNC-OAHLLOKOSA-N |