9-(4-benzylpiperazine-1-carbonyl)-5-(1-methyl-1H-imidazole-4-sulfonyl)-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
9-(4-benzylpiperazine-1-carbonyl)-5-(1-methyl-1H-imidazole-4-sulfonyl)-1,5-diazacycloundecan-2-one
9-(4-benzylpiperazine-1-carbonyl)-5-(1-methyl-1H-imidazole-4-sulfonyl)-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S733-1743 |
| Compound Name: | 9-(4-benzylpiperazine-1-carbonyl)-5-(1-methyl-1H-imidazole-4-sulfonyl)-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 516.66 |
| Molecular Formula: | C25 H36 N6 O4 S |
| Smiles: | Cn1cc(nc1)S(N1CCCC(CCNC(CC1)=O)C(N1CCN(CC1)Cc1ccccc1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.3106 |
| logD: | -0.3623 |
| logSw: | -2.1983 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.904 |
| InChI Key: | UVCDSVQPGLCDMZ-QFIPXVFZSA-N |