dimethyl [2-(4-tert-butylphenyl)-5-{[(4-methoxyphenyl)methyl]amino}-1,3-oxazol-4-yl]phosphonate
Chemical Structure Depiction of
dimethyl [2-(4-tert-butylphenyl)-5-{[(4-methoxyphenyl)methyl]amino}-1,3-oxazol-4-yl]phosphonate
dimethyl [2-(4-tert-butylphenyl)-5-{[(4-methoxyphenyl)methyl]amino}-1,3-oxazol-4-yl]phosphonate
Compound characteristics
| Compound ID: | D055-0055 |
| Compound Name: | dimethyl [2-(4-tert-butylphenyl)-5-{[(4-methoxyphenyl)methyl]amino}-1,3-oxazol-4-yl]phosphonate |
| Molecular Weight: | 444.47 |
| Molecular Formula: | C23 H29 N2 O5 P |
| Smiles: | CC(C)(C)c1ccc(cc1)c1nc(c(NCc2ccc(cc2)OC)o1)P(=O)(OC)OC |
| Stereo: | ACHIRAL |
| logP: | 4.2838 |
| logD: | 4.2838 |
| logSw: | -4.3482 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.719 |
| InChI Key: | SNLMEPXCZSMVPZ-UHFFFAOYSA-N |