N-(4-bromophenyl)-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
Chemical Structure Depiction of
N-(4-bromophenyl)-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
N-(4-bromophenyl)-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
Compound characteristics
| Compound ID: | C097-0017 |
| Compound Name: | N-(4-bromophenyl)-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea |
| Molecular Weight: | 403.15 |
| Molecular Formula: | C15 H10 Br F3 N2 O3 |
| Smiles: | c1ccc2c(c1)OC(C(F)(F)F)(NC(Nc1ccc(cc1)[Br])=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 4.8015 |
| logD: | 4.3417 |
| logSw: | -4.9829 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.633 |
| InChI Key: | XIZJCUKFJYLRQE-UHFFFAOYSA-N |