4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-2-methoxyphenyl 2-chloro-4,5-difluorobenzoate
Chemical Structure Depiction of
4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-2-methoxyphenyl 2-chloro-4,5-difluorobenzoate
4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-2-methoxyphenyl 2-chloro-4,5-difluorobenzoate
Compound characteristics
| Compound ID: | 2144-0949 |
| Compound Name: | 4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-2-methoxyphenyl 2-chloro-4,5-difluorobenzoate |
| Molecular Weight: | 464.81 |
| Molecular Formula: | C21 H15 Cl F2 N2 O6 |
| Smiles: | CN1C(C(=Cc2ccc(c(c2)OC)OC(c2cc(c(cc2[Cl])F)F)=O)C(N(C)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8991 |
| logD: | 3.8991 |
| logSw: | -4.6315 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.22 |
| InChI Key: | TYYGMVKGZVWJQM-UHFFFAOYSA-N |