5-(3-fluorobenzene-1-sulfonyl)-9-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-(3-fluorobenzene-1-sulfonyl)-9-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one
5-(3-fluorobenzene-1-sulfonyl)-9-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S733-0249 |
| Compound Name: | 5-(3-fluorobenzene-1-sulfonyl)-9-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 517.62 |
| Molecular Formula: | C25 H32 F N5 O4 S |
| Smiles: | C1CC(CCNC(CCN(C1)S(c1cccc(c1)F)(=O)=O)=O)C(N1CCN(CC1)c1ccccn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6496 |
| logD: | 1.6408 |
| logSw: | -2.5869 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.724 |
| InChI Key: | BSWXNUGSEUNEFZ-FQEVSTJZSA-N |