9-[4-(4-fluorophenyl)piperazine-1-carbonyl]-5-(1-methyl-1H-imidazole-4-sulfonyl)-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
9-[4-(4-fluorophenyl)piperazine-1-carbonyl]-5-(1-methyl-1H-imidazole-4-sulfonyl)-1,5-diazacycloundecan-2-one
9-[4-(4-fluorophenyl)piperazine-1-carbonyl]-5-(1-methyl-1H-imidazole-4-sulfonyl)-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S733-1801 |
| Compound Name: | 9-[4-(4-fluorophenyl)piperazine-1-carbonyl]-5-(1-methyl-1H-imidazole-4-sulfonyl)-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 520.63 |
| Molecular Formula: | C24 H33 F N6 O4 S |
| Smiles: | Cn1cc(nc1)S(N1CCCC(CCNC(CC1)=O)C(N1CCN(CC1)c1ccc(cc1)F)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.159 |
| logD: | 0.159 |
| logSw: | -2.2813 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.624 |
| InChI Key: | RNBRCJACYWKOSA-IBGZPJMESA-N |