2-methoxy-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenyl 2-chloro-4,5-difluorobenzoate
Chemical Structure Depiction of
2-methoxy-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenyl 2-chloro-4,5-difluorobenzoate
2-methoxy-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenyl 2-chloro-4,5-difluorobenzoate
Compound characteristics
Compound ID: | 8007-7925 |
Compound Name: | 2-methoxy-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenyl 2-chloro-4,5-difluorobenzoate |
Molecular Weight: | 436.75 |
Molecular Formula: | C19 H11 Cl F2 N2 O6 |
Smiles: | [H]N1C(C(=Cc2ccc(c(c2)OC)OC(c2cc(c(cc2[Cl])F)F)=O)C(N([H])C1=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.0416 |
logD: | 2.6944 |
logSw: | -3.7982 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 90.738 |
InChI Key: | HTKRAUNYCJTFII-UHFFFAOYSA-N |