methyl 4-({[2-(2-bromophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}amino)benzoate
Chemical Structure Depiction of
methyl 4-({[2-(2-bromophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}amino)benzoate
methyl 4-({[2-(2-bromophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}amino)benzoate
Compound characteristics
| Compound ID: | 1989-9473 |
| Compound Name: | methyl 4-({[2-(2-bromophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}amino)benzoate |
| Molecular Weight: | 401.21 |
| Molecular Formula: | C18 H13 Br N2 O4 |
| Smiles: | COC(c1ccc(cc1)N/C=C1/C(=O)OC(c2ccccc2[Br])=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4059 |
| logD: | 3.4049 |
| logSw: | -3.8457 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.15 |
| InChI Key: | JLABVOQDCTZYHO-UHFFFAOYSA-N |