dimethyl [5-{[(4-methoxyphenyl)methyl]amino}-2-(3-nitrophenyl)-1,3-oxazol-4-yl]phosphonate
Chemical Structure Depiction of
dimethyl [5-{[(4-methoxyphenyl)methyl]amino}-2-(3-nitrophenyl)-1,3-oxazol-4-yl]phosphonate
dimethyl [5-{[(4-methoxyphenyl)methyl]amino}-2-(3-nitrophenyl)-1,3-oxazol-4-yl]phosphonate
Compound characteristics
| Compound ID: | D055-0174 |
| Compound Name: | dimethyl [5-{[(4-methoxyphenyl)methyl]amino}-2-(3-nitrophenyl)-1,3-oxazol-4-yl]phosphonate |
| Molecular Weight: | 433.36 |
| Molecular Formula: | C19 H20 N3 O7 P |
| Smiles: | COc1ccc(CNc2c(nc(c3cccc(c3)[N+]([O-])=O)o2)P(=O)(OC)OC)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.3549 |
| logD: | 2.3549 |
| logSw: | -2.7804 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.1 |
| InChI Key: | DKLUSTVYDABFRO-UHFFFAOYSA-N |