5-(1-methyl-1H-imidazole-4-sulfonyl)-9-[4-(2-methylpropyl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-(1-methyl-1H-imidazole-4-sulfonyl)-9-[4-(2-methylpropyl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one
5-(1-methyl-1H-imidazole-4-sulfonyl)-9-[4-(2-methylpropyl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S733-1807 |
| Compound Name: | 5-(1-methyl-1H-imidazole-4-sulfonyl)-9-[4-(2-methylpropyl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 482.64 |
| Molecular Formula: | C22 H38 N6 O4 S |
| Smiles: | CC(C)CN1CCN(CC1)C(C1CCCN(CCC(NCC1)=O)S(c1cn(C)cn1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.5328 |
| logD: | -0.9964 |
| logSw: | -1.7801 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.175 |
| InChI Key: | QAHYPWBAXWKTMG-IBGZPJMESA-N |