N-(4-butylphenyl)-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
Chemical Structure Depiction of
N-(4-butylphenyl)-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
N-(4-butylphenyl)-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
Compound characteristics
| Compound ID: | C097-0013 |
| Compound Name: | N-(4-butylphenyl)-N'-[2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea |
| Molecular Weight: | 380.37 |
| Molecular Formula: | C19 H19 F3 N2 O3 |
| Smiles: | CCCCc1ccc(cc1)NC(NC1(C(F)(F)F)Oc2ccccc2O1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9369 |
| logD: | 5.4771 |
| logSw: | -5.5668 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.633 |
| InChI Key: | HJRUCONFYQSEEA-UHFFFAOYSA-N |