dimethyl [2-(4-tert-butylphenyl)-5-{[(2-chlorophenyl)methyl]amino}-1,3-oxazol-4-yl]phosphonate
Chemical Structure Depiction of
dimethyl [2-(4-tert-butylphenyl)-5-{[(2-chlorophenyl)methyl]amino}-1,3-oxazol-4-yl]phosphonate
dimethyl [2-(4-tert-butylphenyl)-5-{[(2-chlorophenyl)methyl]amino}-1,3-oxazol-4-yl]phosphonate
Compound characteristics
| Compound ID: | D055-0058 |
| Compound Name: | dimethyl [2-(4-tert-butylphenyl)-5-{[(2-chlorophenyl)methyl]amino}-1,3-oxazol-4-yl]phosphonate |
| Molecular Weight: | 448.89 |
| Molecular Formula: | C22 H26 Cl N2 O4 P |
| Smiles: | CC(C)(C)c1ccc(cc1)c1nc(c(NCc2ccccc2[Cl])o1)P(=O)(OC)OC |
| Stereo: | ACHIRAL |
| logP: | 5.0834 |
| logD: | 5.0834 |
| logSw: | -5.5482 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.175 |
| InChI Key: | XODYJJGMAQQTPT-UHFFFAOYSA-N |