5-(benzenesulfonyl)-9-(4-benzylpiperazine-1-carbonyl)-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-(benzenesulfonyl)-9-(4-benzylpiperazine-1-carbonyl)-1,5-diazacycloundecan-2-one
5-(benzenesulfonyl)-9-(4-benzylpiperazine-1-carbonyl)-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S733-1546 |
| Compound Name: | 5-(benzenesulfonyl)-9-(4-benzylpiperazine-1-carbonyl)-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 512.67 |
| Molecular Formula: | C27 H36 N4 O4 S |
| Smiles: | C1CC(CCNC(CCN(C1)S(c1ccccc1)(=O)=O)=O)C(N1CCN(CC1)Cc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3886 |
| logD: | 1.3369 |
| logSw: | -2.3872 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.493 |
| InChI Key: | MSIBKXLYONDJNQ-DEOSSOPVSA-N |