diethyl (2-[(4-nitrophenyl)methyl]-5-{[(pyridin-3-yl)methyl]amino}-1,3-oxazol-4-yl)phosphonate
Chemical Structure Depiction of
diethyl (2-[(4-nitrophenyl)methyl]-5-{[(pyridin-3-yl)methyl]amino}-1,3-oxazol-4-yl)phosphonate
diethyl (2-[(4-nitrophenyl)methyl]-5-{[(pyridin-3-yl)methyl]amino}-1,3-oxazol-4-yl)phosphonate
Compound characteristics
| Compound ID: | D142-0122 |
| Compound Name: | diethyl (2-[(4-nitrophenyl)methyl]-5-{[(pyridin-3-yl)methyl]amino}-1,3-oxazol-4-yl)phosphonate |
| Molecular Weight: | 446.4 |
| Molecular Formula: | C20 H23 N4 O6 P |
| Smiles: | CCOP(c1c(NCc2cccnc2)oc(Cc2ccc(cc2)[N+]([O-])=O)n1)(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 2.2112 |
| logD: | 2.1966 |
| logSw: | -1.975 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.515 |
| InChI Key: | VZEGUIGOPNMDQE-UHFFFAOYSA-N |