2-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-5-[(4-methoxyphenyl)methyl]tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
Chemical Structure Depiction of
2-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-5-[(4-methoxyphenyl)methyl]tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
2-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-5-[(4-methoxyphenyl)methyl]tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
Compound characteristics
Compound ID: | S296-2739 |
Compound Name: | 2-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-5-[(4-methoxyphenyl)methyl]tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione |
Molecular Weight: | 419.52 |
Molecular Formula: | C25 H29 N3 O3 |
Smiles: | COc1ccc(CN2C[C@H]3C(N(CCN4CCc5ccccc5C4)C([C@H]3C2)=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 2.2525 |
logD: | 1.1461 |
logSw: | -2.6723 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 44.623 |
InChI Key: | GUQNRLWKFOMRBK-GOTSBHOMSA-N |