1-(methanesulfonyl)-4-oxo-N-[2-(pyridin-2-yl)ethyl]-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
1-(methanesulfonyl)-4-oxo-N-[2-(pyridin-2-yl)ethyl]-1,5-diazacycloundecane-8-carboxamide
1-(methanesulfonyl)-4-oxo-N-[2-(pyridin-2-yl)ethyl]-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
Compound ID: | S733-1391 |
Compound Name: | 1-(methanesulfonyl)-4-oxo-N-[2-(pyridin-2-yl)ethyl]-1,5-diazacycloundecane-8-carboxamide |
Molecular Weight: | 396.51 |
Molecular Formula: | C18 H28 N4 O4 S |
Smiles: | CS(N1CCCC(CCNC(CC1)=O)C(NCCc1ccccn1)=O)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | -1.0752 |
logD: | -1.08 |
logSw: | -2.0487 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 90.866 |
InChI Key: | WHNHZYGMROSQPL-HNNXBMFYSA-N |