N-(3,5-difluorophenyl)-4-{[(2-methoxyphenyl)methyl]amino}-3-nitrobenzamide
Chemical Structure Depiction of
N-(3,5-difluorophenyl)-4-{[(2-methoxyphenyl)methyl]amino}-3-nitrobenzamide
N-(3,5-difluorophenyl)-4-{[(2-methoxyphenyl)methyl]amino}-3-nitrobenzamide
Compound characteristics
| Compound ID: | K781-6776 |
| Compound Name: | N-(3,5-difluorophenyl)-4-{[(2-methoxyphenyl)methyl]amino}-3-nitrobenzamide |
| Molecular Weight: | 413.38 |
| Molecular Formula: | C21 H17 F2 N3 O4 |
| Smiles: | COc1ccccc1CNc1ccc(cc1[N+]([O-])=O)C(Nc1cc(cc(c1)F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8997 |
| logD: | 3.5921 |
| logSw: | -4.7091 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.577 |
| InChI Key: | LOIOKHAIHKNZHF-UHFFFAOYSA-N |