{4-[(3-fluorophenyl)methanesulfonyl]-3-nitrophenyl}(4-methylpiperidin-1-yl)methanone
Chemical Structure Depiction of
{4-[(3-fluorophenyl)methanesulfonyl]-3-nitrophenyl}(4-methylpiperidin-1-yl)methanone
{4-[(3-fluorophenyl)methanesulfonyl]-3-nitrophenyl}(4-methylpiperidin-1-yl)methanone
Compound characteristics
| Compound ID: | K673-0082 |
| Compound Name: | {4-[(3-fluorophenyl)methanesulfonyl]-3-nitrophenyl}(4-methylpiperidin-1-yl)methanone |
| Molecular Weight: | 420.46 |
| Molecular Formula: | C20 H21 F N2 O5 S |
| Smiles: | CC1CCN(CC1)C(c1ccc(c(c1)[N+]([O-])=O)S(Cc1cccc(c1)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5178 |
| logD: | 3.5178 |
| logSw: | -3.987 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.732 |
| InChI Key: | NAEFYYSGQKULFI-UHFFFAOYSA-N |