N-cyclododecyl-N'-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
Chemical Structure Depiction of
N-cyclododecyl-N'-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
N-cyclododecyl-N'-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea
Compound characteristics
| Compound ID: | C097-0403 |
| Compound Name: | N-cyclododecyl-N'-[5,6-dichloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]urea |
| Molecular Weight: | 483.36 |
| Molecular Formula: | C21 H27 Cl2 F3 N2 O3 |
| Smiles: | C1CCCCCC(CCCCC1)NC(NC1(C(F)(F)F)Oc2cc(c(cc2O1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 7.8142 |
| logD: | 7.4815 |
| logSw: | -6.9329 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.011 |
| InChI Key: | CSLMTHIHHAMTBS-UHFFFAOYSA-N |