methyl 4-({[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}amino)benzoate
Chemical Structure Depiction of
methyl 4-({[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}amino)benzoate
methyl 4-({[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}amino)benzoate
Compound characteristics
Compound ID: | K091-1102 |
Compound Name: | methyl 4-({[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}amino)benzoate |
Molecular Weight: | 336.35 |
Molecular Formula: | C19 H16 N2 O4 |
Smiles: | Cc1ccc(cc1)C1=NC(=C\Nc2ccc(cc2)C(=O)OC)\C(=O)O1 |
Stereo: | ACHIRAL |
logP: | 3.5562 |
logD: | 3.5551 |
logSw: | -3.6158 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.15 |
InChI Key: | RNMXYZNSHHWUIM-UHFFFAOYSA-N |