5-benzoyl-4-hydroxy-6-[5-(3-nitrophenyl)furan-2-yl]-4-(trifluoromethyl)-1,3-diazinan-2-one
Chemical Structure Depiction of
5-benzoyl-4-hydroxy-6-[5-(3-nitrophenyl)furan-2-yl]-4-(trifluoromethyl)-1,3-diazinan-2-one
5-benzoyl-4-hydroxy-6-[5-(3-nitrophenyl)furan-2-yl]-4-(trifluoromethyl)-1,3-diazinan-2-one
Compound characteristics
| Compound ID: | 4618-0165 |
| Compound Name: | 5-benzoyl-4-hydroxy-6-[5-(3-nitrophenyl)furan-2-yl]-4-(trifluoromethyl)-1,3-diazinan-2-one |
| Molecular Weight: | 475.38 |
| Molecular Formula: | C22 H16 F3 N3 O6 |
| Smiles: | c1ccc(cc1)C(C1C(c2ccc(c3cccc(c3)[N+]([O-])=O)o2)NC(NC1(C(F)(F)F)O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7662 |
| logD: | 3.7659 |
| logSw: | -4.0771 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 108.403 |
| InChI Key: | SWDHZKXTZGDMIV-UHFFFAOYSA-N |