5-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-9-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-9-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one
5-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-9-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S733-0261 |
| Compound Name: | 5-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-9-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 518.63 |
| Molecular Formula: | C24 H34 N6 O5 S |
| Smiles: | Cc1c(c(C)on1)S(N1CCCC(CCNC(CC1)=O)C(N1CCN(CC1)c1ccccn1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.2692 |
| logD: | 0.2604 |
| logSw: | -2.308 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 107.762 |
| InChI Key: | DNBUANPWOJDNGN-FQEVSTJZSA-N |