diethyl [5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-(3-nitrophenyl)-1,3-oxazol-4-yl]phosphonate
Chemical Structure Depiction of
diethyl [5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-(3-nitrophenyl)-1,3-oxazol-4-yl]phosphonate
diethyl [5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-(3-nitrophenyl)-1,3-oxazol-4-yl]phosphonate
Compound characteristics
| Compound ID: | D055-0372 |
| Compound Name: | diethyl [5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-(3-nitrophenyl)-1,3-oxazol-4-yl]phosphonate |
| Molecular Weight: | 505.46 |
| Molecular Formula: | C23 H28 N3 O8 P |
| Smiles: | CCOP(c1c(NCCc2ccc(c(c2)OC)OC)oc(c2cccc(c2)[N+]([O-])=O)n1)(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 2.9927 |
| logD: | 2.9927 |
| logSw: | -3.3917 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 107.433 |
| InChI Key: | ORZUGCXNAMRSJK-UHFFFAOYSA-N |