N-[4-chloro-3-(trifluoromethyl)phenyl]-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-[4-chloro-3-(trifluoromethyl)phenyl]-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazole-3-carboxamide
N-[4-chloro-3-(trifluoromethyl)phenyl]-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazole-3-carboxamide
Compound characteristics
Compound ID: | D337-1311 |
Compound Name: | N-[4-chloro-3-(trifluoromethyl)phenyl]-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazole-3-carboxamide |
Molecular Weight: | 424.76 |
Molecular Formula: | C19 H12 Cl F3 N2 O4 |
Smiles: | [H]N(C(c1cc(c2ccc3c(c2)OCCO3)on1)=O)c1ccc(c(c1)C(F)(F)F)[Cl] |
Stereo: | ACHIRAL |
logP: | 4.4057 |
logD: | 4.3589 |
logSw: | -4.7093 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.688 |
InChI Key: | DCEYMUNMOSBYKQ-UHFFFAOYSA-N |