1-(3-fluorobenzene-1-sulfonyl)-4-oxo-N-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
1-(3-fluorobenzene-1-sulfonyl)-4-oxo-N-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
1-(3-fluorobenzene-1-sulfonyl)-4-oxo-N-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-1252 |
| Compound Name: | 1-(3-fluorobenzene-1-sulfonyl)-4-oxo-N-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 462.54 |
| Molecular Formula: | C22 H27 F N4 O4 S |
| Smiles: | C1CC(CCNC(CCN(C1)S(c1cccc(c1)F)(=O)=O)=O)C(NCc1ccncc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.0771 |
| logD: | 0.0737 |
| logSw: | -1.9946 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.146 |
| InChI Key: | KWXBGZVAQKKSOA-SFHVURJKSA-N |