N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-(2-nitrophenyl)urea
Chemical Structure Depiction of
N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-(2-nitrophenyl)urea
N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-(2-nitrophenyl)urea
Compound characteristics
| Compound ID: | C097-0186 |
| Compound Name: | N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-(2-nitrophenyl)urea |
| Molecular Weight: | 403.7 |
| Molecular Formula: | C15 H9 Cl F3 N3 O5 |
| Smiles: | c1ccc(c(c1)NC(NC1(C(F)(F)F)Oc2ccc(cc2O1)[Cl])=O)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5201 |
| logD: | 2.887 |
| logSw: | -4.955 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.016 |
| InChI Key: | SBXAOOLEPPCHRX-HNNXBMFYSA-N |