N-[(4-methylphenyl)methyl]-2-[2-oxo-7-(pyrrolidine-1-sulfonyl)-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-2-[2-oxo-7-(pyrrolidine-1-sulfonyl)-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetamide
N-[(4-methylphenyl)methyl]-2-[2-oxo-7-(pyrrolidine-1-sulfonyl)-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetamide
Compound characteristics
Compound ID: | L707-0069 |
Compound Name: | N-[(4-methylphenyl)methyl]-2-[2-oxo-7-(pyrrolidine-1-sulfonyl)-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetamide |
Molecular Weight: | 455.58 |
Molecular Formula: | C24 H29 N3 O4 S |
Smiles: | Cc1ccc(CNC(CN2C(CCCc3cc(ccc23)S(N2CCCC2)(=O)=O)=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.3317 |
logD: | 3.3317 |
logSw: | -3.8744 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.498 |
InChI Key: | JSXURMGYXYNLBG-UHFFFAOYSA-N |