5-(benzenesulfonyl)-9-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-(benzenesulfonyl)-9-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one
5-(benzenesulfonyl)-9-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S733-1563 |
| Compound Name: | 5-(benzenesulfonyl)-9-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 526.7 |
| Molecular Formula: | C28 H38 N4 O4 S |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)C(C1CCCN(CCC(NCC1)=O)S(c1ccccc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8311 |
| logD: | 2.8311 |
| logSw: | -3.4566 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.912 |
| InChI Key: | GHUBJGCSJRIFNU-DEOSSOPVSA-N |