7,8-dimethoxy-3-[2-oxo-2-(1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl)ethyl]-1,3-dihydro-2H-3-benzazepin-2-one
Chemical Structure Depiction of
7,8-dimethoxy-3-[2-oxo-2-(1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl)ethyl]-1,3-dihydro-2H-3-benzazepin-2-one
7,8-dimethoxy-3-[2-oxo-2-(1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl)ethyl]-1,3-dihydro-2H-3-benzazepin-2-one
Compound characteristics
| Compound ID: | Y042-1479 |
| Compound Name: | 7,8-dimethoxy-3-[2-oxo-2-(1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl)ethyl]-1,3-dihydro-2H-3-benzazepin-2-one |
| Molecular Weight: | 431.49 |
| Molecular Formula: | C25 H25 N3 O4 |
| Smiles: | COc1cc2CC(N(CC(N3CCc4c5ccccc5[nH]c4C3)=O)C=Cc2cc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3342 |
| logD: | 1.3342 |
| logSw: | -2.3553 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.455 |
| InChI Key: | WXFVCJMMWSJEME-UHFFFAOYSA-N |