N-[(3,5-difluorophenyl)methyl]-1-(methanesulfonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-[(3,5-difluorophenyl)methyl]-1-(methanesulfonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
N-[(3,5-difluorophenyl)methyl]-1-(methanesulfonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
Compound ID: | S733-1363 |
Compound Name: | N-[(3,5-difluorophenyl)methyl]-1-(methanesulfonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide |
Molecular Weight: | 417.47 |
Molecular Formula: | C18 H25 F2 N3 O4 S |
Smiles: | CS(N1CCCC(CCNC(CC1)=O)C(NCc1cc(cc(c1)F)F)=O)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 0.1922 |
logD: | 0.1922 |
logSw: | -1.9135 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 81.481 |
InChI Key: | TVSPHBZIXNBFAL-AWEZNQCLSA-N |