7-(azepane-1-sulfonyl)-1-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
Chemical Structure Depiction of
7-(azepane-1-sulfonyl)-1-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
7-(azepane-1-sulfonyl)-1-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
Compound characteristics
| Compound ID: | L707-2077 |
| Compound Name: | 7-(azepane-1-sulfonyl)-1-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one |
| Molecular Weight: | 462.61 |
| Molecular Formula: | C23 H34 N4 O4 S |
| Smiles: | CN1CCN(CC1)C(CN1C(CCCc2cc(ccc12)S(N1CCCCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9034 |
| logD: | 1.7728 |
| logSw: | -2.7141 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.861 |
| InChI Key: | JLRIWIVAHQTKSO-UHFFFAOYSA-N |