7-[4-(5-chloro-2-methylphenyl)piperazine-1-sulfonyl]-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
Chemical Structure Depiction of
7-[4-(5-chloro-2-methylphenyl)piperazine-1-sulfonyl]-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
7-[4-(5-chloro-2-methylphenyl)piperazine-1-sulfonyl]-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one
Compound characteristics
| Compound ID: | E977-0082 |
| Compound Name: | 7-[4-(5-chloro-2-methylphenyl)piperazine-1-sulfonyl]-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one |
| Molecular Weight: | 433.96 |
| Molecular Formula: | C21 H24 Cl N3 O3 S |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)S(c1ccc2c(CCCC(N2)=O)c1)(=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.6789 |
| logD: | 3.6789 |
| logSw: | -4.0614 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.061 |
| InChI Key: | ZDODNIMWULKDLZ-UHFFFAOYSA-N |