1-(benzenesulfonyl)-N-({1-[(4-fluorophenyl)methyl]piperidin-4-yl}methyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
1-(benzenesulfonyl)-N-({1-[(4-fluorophenyl)methyl]piperidin-4-yl}methyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
1-(benzenesulfonyl)-N-({1-[(4-fluorophenyl)methyl]piperidin-4-yl}methyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-1687 |
| Compound Name: | 1-(benzenesulfonyl)-N-({1-[(4-fluorophenyl)methyl]piperidin-4-yl}methyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 558.72 |
| Molecular Formula: | C29 H39 F N4 O4 S |
| Smiles: | C1CC(CCNC(CCN(C1)S(c1ccccc1)(=O)=O)=O)C(NCC1CCN(CC1)Cc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1362 |
| logD: | 0.3468 |
| logSw: | -2.639 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.45 |
| InChI Key: | IINAYMVWSQDBLX-VWLOTQADSA-N |