dimethyl (5-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-phenyl-1,3-oxazol-4-yl)phosphonate
Chemical Structure Depiction of
dimethyl (5-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-phenyl-1,3-oxazol-4-yl)phosphonate
dimethyl (5-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-phenyl-1,3-oxazol-4-yl)phosphonate
Compound characteristics
| Compound ID: | D055-0009 |
| Compound Name: | dimethyl (5-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-phenyl-1,3-oxazol-4-yl)phosphonate |
| Molecular Weight: | 402.34 |
| Molecular Formula: | C19 H19 N2 O6 P |
| Smiles: | COP(c1c(NCc2ccc3c(c2)OCO3)oc(c2ccccc2)n1)(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.315 |
| logD: | 2.315 |
| logSw: | -2.7445 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.29 |
| InChI Key: | BNUIVHQWJXVSIQ-UHFFFAOYSA-N |