dimethyl [5-{[(2-chlorophenyl)methyl]amino}-2-(4-nitrophenyl)-1,3-oxazol-4-yl]phosphonate
Chemical Structure Depiction of
dimethyl [5-{[(2-chlorophenyl)methyl]amino}-2-(4-nitrophenyl)-1,3-oxazol-4-yl]phosphonate
dimethyl [5-{[(2-chlorophenyl)methyl]amino}-2-(4-nitrophenyl)-1,3-oxazol-4-yl]phosphonate
Compound characteristics
| Compound ID: | D142-0043 |
| Compound Name: | dimethyl [5-{[(2-chlorophenyl)methyl]amino}-2-(4-nitrophenyl)-1,3-oxazol-4-yl]phosphonate |
| Molecular Weight: | 437.77 |
| Molecular Formula: | C18 H17 Cl N3 O6 P |
| Smiles: | COP(c1c(NCc2ccccc2[Cl])oc(c2ccc(cc2)[N+]([O-])=O)n1)(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.2146 |
| logD: | 3.2146 |
| logSw: | -3.7753 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.557 |
| InChI Key: | KXXYBTJSVQIQGW-UHFFFAOYSA-N |