N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-(3-nitrophenyl)urea
Chemical Structure Depiction of
N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-(3-nitrophenyl)urea
N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-(3-nitrophenyl)urea
Compound characteristics
| Compound ID: | C097-0187 |
| Compound Name: | N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-N'-(3-nitrophenyl)urea |
| Molecular Weight: | 403.7 |
| Molecular Formula: | C15 H9 Cl F3 N3 O5 |
| Smiles: | c1cc(cc(c1)[N+]([O-])=O)NC(NC1(C(F)(F)F)Oc2ccc(cc2O1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8405 |
| logD: | 4.0977 |
| logSw: | -5.1469 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.014 |
| InChI Key: | UEDROQUUWVWZDG-HNNXBMFYSA-N |