3-[4-(3,5-dinitrophenoxy)phenyl]-1-(2-methylpiperidin-1-yl)propan-1-one
Chemical Structure Depiction of
3-[4-(3,5-dinitrophenoxy)phenyl]-1-(2-methylpiperidin-1-yl)propan-1-one
3-[4-(3,5-dinitrophenoxy)phenyl]-1-(2-methylpiperidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | 8007-3662 |
| Compound Name: | 3-[4-(3,5-dinitrophenoxy)phenyl]-1-(2-methylpiperidin-1-yl)propan-1-one |
| Molecular Weight: | 413.43 |
| Molecular Formula: | C21 H23 N3 O6 |
| Smiles: | CC1CCCCN1C(CCc1ccc(cc1)Oc1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6108 |
| logD: | 4.6108 |
| logSw: | -4.4062 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 89.155 |
| InChI Key: | PBRWPEWJXJAVEN-HNNXBMFYSA-N |