dimethyl [5-{[(2-chlorophenyl)methyl]amino}-2-(3,4-dimethoxyphenyl)-1,3-oxazol-4-yl]phosphonate
Chemical Structure Depiction of
dimethyl [5-{[(2-chlorophenyl)methyl]amino}-2-(3,4-dimethoxyphenyl)-1,3-oxazol-4-yl]phosphonate
dimethyl [5-{[(2-chlorophenyl)methyl]amino}-2-(3,4-dimethoxyphenyl)-1,3-oxazol-4-yl]phosphonate
Compound characteristics
| Compound ID: | D055-0192 |
| Compound Name: | dimethyl [5-{[(2-chlorophenyl)methyl]amino}-2-(3,4-dimethoxyphenyl)-1,3-oxazol-4-yl]phosphonate |
| Molecular Weight: | 452.83 |
| Molecular Formula: | C20 H22 Cl N2 O6 P |
| Smiles: | COc1ccc(cc1OC)c1nc(c(NCc2ccccc2[Cl])o1)P(=O)(OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.8329 |
| logD: | 2.8329 |
| logSw: | -3.6766 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.436 |
| InChI Key: | GRVVRNWKHZRJAB-UHFFFAOYSA-N |