dimethyl [5-{[(2-chlorophenyl)methyl]amino}-2-(thiophen-2-yl)-1,3-oxazol-4-yl]phosphonate
Chemical Structure Depiction of
dimethyl [5-{[(2-chlorophenyl)methyl]amino}-2-(thiophen-2-yl)-1,3-oxazol-4-yl]phosphonate
dimethyl [5-{[(2-chlorophenyl)methyl]amino}-2-(thiophen-2-yl)-1,3-oxazol-4-yl]phosphonate
Compound characteristics
| Compound ID: | D055-0132 |
| Compound Name: | dimethyl [5-{[(2-chlorophenyl)methyl]amino}-2-(thiophen-2-yl)-1,3-oxazol-4-yl]phosphonate |
| Molecular Weight: | 398.8 |
| Molecular Formula: | C16 H16 Cl N2 O4 P S |
| Smiles: | COP(c1c(NCc2ccccc2[Cl])oc(c2cccs2)n1)(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.1306 |
| logD: | 3.1306 |
| logSw: | -3.5318 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.193 |
| InChI Key: | VQRIFLDXXPREIK-UHFFFAOYSA-N |