dimethyl [2-(4-tert-butylphenyl)-5-{[(4-methylphenyl)methyl]amino}-1,3-oxazol-4-yl]phosphonate
Chemical Structure Depiction of
dimethyl [2-(4-tert-butylphenyl)-5-{[(4-methylphenyl)methyl]amino}-1,3-oxazol-4-yl]phosphonate
dimethyl [2-(4-tert-butylphenyl)-5-{[(4-methylphenyl)methyl]amino}-1,3-oxazol-4-yl]phosphonate
Compound characteristics
Compound ID: | D055-0053 |
Compound Name: | dimethyl [2-(4-tert-butylphenyl)-5-{[(4-methylphenyl)methyl]amino}-1,3-oxazol-4-yl]phosphonate |
Molecular Weight: | 428.47 |
Molecular Formula: | C23 H29 N2 O4 P |
Smiles: | Cc1ccc(CNc2c(nc(c3ccc(cc3)C(C)(C)C)o2)P(=O)(OC)OC)cc1 |
Stereo: | ACHIRAL |
logP: | 4.7248 |
logD: | 4.7248 |
logSw: | -4.5712 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.175 |
InChI Key: | MMYPEZUHYUEHAD-UHFFFAOYSA-N |