N-(3-acetylphenyl)-2-[7-(azepane-1-sulfonyl)-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-[7-(azepane-1-sulfonyl)-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetamide
N-(3-acetylphenyl)-2-[7-(azepane-1-sulfonyl)-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetamide
Compound characteristics
| Compound ID: | L707-2088 |
| Compound Name: | N-(3-acetylphenyl)-2-[7-(azepane-1-sulfonyl)-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetamide |
| Molecular Weight: | 497.61 |
| Molecular Formula: | C26 H31 N3 O5 S |
| Smiles: | CC(c1cccc(c1)NC(CN1C(CCCc2cc(ccc12)S(N1CCCCCC1)(=O)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8979 |
| logD: | 3.8977 |
| logSw: | -3.9198 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.968 |
| InChI Key: | GMOSBLHNMABUKT-UHFFFAOYSA-N |