[rel-(3aR,6aR)-5-benzyl-3a-[(dimethylamino)methyl]hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl](thiophen-2-yl)methanone
Chemical Structure Depiction of
[rel-(3aR,6aR)-5-benzyl-3a-[(dimethylamino)methyl]hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl](thiophen-2-yl)methanone
[rel-(3aR,6aR)-5-benzyl-3a-[(dimethylamino)methyl]hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl](thiophen-2-yl)methanone
Compound characteristics
| Compound ID: | S986-0119 |
| Compound Name: | [rel-(3aR,6aR)-5-benzyl-3a-[(dimethylamino)methyl]hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl](thiophen-2-yl)methanone |
| Molecular Weight: | 369.53 |
| Molecular Formula: | C21 H27 N3 O S |
| Smiles: | CN(C)C[C@]12CN(Cc3ccccc3)C[C@@H]2CN(C1)C(c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.4936 |
| logD: | -2.1863 |
| logSw: | -2.4642 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.7191 |
| InChI Key: | NFOCTLQNGXOKSW-RXVVDRJESA-N |